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Benzothiadiazoles

Organic heterocyclic compounds that consist of a benzene fused with a thiadiazole ring; thiadiazoles have a five-membered ring that contains two nitrogen atoms, one sulfur atoms, and two double bonds.
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16 – 30 of 89 results
16

Methyl 2,1,3-benzothiadiazole-5-carboxylate, 98%

CAS: 175204-21-4 Molecular Formula: C8H6N2O2S Molecular Weight (g/mol): 194.21 MDL Number: MFCD00173948 InChI Key: LRMFSMKHXKDUDG-UHFFFAOYSA-N Synonym: methyl benzo-2,1,3-thiadiazole-5-carboxylate,2,1,3-benzothiadiazole-5-carboxylicacid, methyl ester,methyl benzo c 1,2,5-thiadiazole-5-carboxylate,acmc-20akfm,methylbenzo-2,1,3-thiadiazole-5-carboxylate,methyl benzo 1,2,5 thiadiazole-5-carboxylate,methyl benzo c 1,2,5 thiadiazole-5-carboxylate,2,1,3-benzothiadiazole-5-carboxylic acid methyl ester,benzo 1,2,5 thiadiazole-5-carboxylic acid methyl ester PubChem CID: 696381 IUPAC Name: methyl 2,1,3-benzothiadiazole-5-carboxylate SMILES: COC(=O)C1=CC2=NSN=C2C=C1

PubChem CID 696381
CAS 175204-21-4
Molecular Weight (g/mol) 194.21
MDL Number MFCD00173948
SMILES COC(=O)C1=CC2=NSN=C2C=C1
Synonym methyl benzo-2,1,3-thiadiazole-5-carboxylate,2,1,3-benzothiadiazole-5-carboxylicacid, methyl ester,methyl benzo c 1,2,5-thiadiazole-5-carboxylate,acmc-20akfm,methylbenzo-2,1,3-thiadiazole-5-carboxylate,methyl benzo 1,2,5 thiadiazole-5-carboxylate,methyl benzo c 1,2,5 thiadiazole-5-carboxylate,2,1,3-benzothiadiazole-5-carboxylic acid methyl ester,benzo 1,2,5 thiadiazole-5-carboxylic acid methyl ester
IUPAC Name methyl 2,1,3-benzothiadiazole-5-carboxylate
InChI Key LRMFSMKHXKDUDG-UHFFFAOYSA-N
Molecular Formula C8H6N2O2S
17

Benzo[c][1,2,5]thiadiazole-5-boronic acid pinacol ester, 97%

CAS: 1168135-03-2 Molecular Formula: C12H15BN2O2S Molecular Weight (g/mol): 262.13 MDL Number: MFCD11867874 InChI Key: KISHNZJGTMYYKH-UHFFFAOYSA-N Synonym: benzo c 1,2,5 thiadiazole-5-boronic acid pinacol ester,5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzo c 1,2,5 thiadiazole,5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-2,1,3-benzothiadiazole,2,1,3-benzothiadiazole-5-boronic acid, pinacol ester,benzo c 1,2,5 thiadiazol-5-ylboronic acid pinacol ester,amtb346,benzo c 1,2,5 thiadiazole-5-boronic acid, pinacol ester PubChem CID: 46738015 IUPAC Name: 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,1,3-benzothiadiazole SMILES: CC1(C)OB(OC1(C)C)C1=CC2=NSN=C2C=C1

PubChem CID 46738015
CAS 1168135-03-2
Molecular Weight (g/mol) 262.13
MDL Number MFCD11867874
SMILES CC1(C)OB(OC1(C)C)C1=CC2=NSN=C2C=C1
Synonym benzo c 1,2,5 thiadiazole-5-boronic acid pinacol ester,5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzo c 1,2,5 thiadiazole,5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-2,1,3-benzothiadiazole,2,1,3-benzothiadiazole-5-boronic acid, pinacol ester,benzo c 1,2,5 thiadiazol-5-ylboronic acid pinacol ester,amtb346,benzo c 1,2,5 thiadiazole-5-boronic acid, pinacol ester
IUPAC Name 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,1,3-benzothiadiazole
InChI Key KISHNZJGTMYYKH-UHFFFAOYSA-N
Molecular Formula C12H15BN2O2S
18

4-Iodo-2,1,3-benzothiadiazole, 97%, Thermo Scientific™

CAS: 352018-95-2 Molecular Formula: C6H3IN2S Molecular Weight (g/mol): 262.07 MDL Number: MFCD02681904 InChI Key: ROPRWVSWECJQIC-UHFFFAOYSA-N Synonym: 4-iodobenzo c 1,2,5 thiadiazole,2,1,3-benzothiadiazole,4-iodo,4-iodo-benzo 1,2,5 thiadiazole,4-iodanyl-2,1,3-benzothiadiazole,4-iodobenzo c 1,2,5-thiadiazole,4-iodo-2,1,3-benzothiadiazole PubChem CID: 2776287 IUPAC Name: 4-iodo-2,1,3-benzothiadiazole SMILES: IC1=CC=CC2=NSN=C12

PubChem CID 2776287
CAS 352018-95-2
Molecular Weight (g/mol) 262.07
MDL Number MFCD02681904
SMILES IC1=CC=CC2=NSN=C12
Synonym 4-iodobenzo c 1,2,5 thiadiazole,2,1,3-benzothiadiazole,4-iodo,4-iodo-benzo 1,2,5 thiadiazole,4-iodanyl-2,1,3-benzothiadiazole,4-iodobenzo c 1,2,5-thiadiazole,4-iodo-2,1,3-benzothiadiazole
IUPAC Name 4-iodo-2,1,3-benzothiadiazole
InChI Key ROPRWVSWECJQIC-UHFFFAOYSA-N
Molecular Formula C6H3IN2S
19

2,1,3-Benzothiadiazol-5-yl isothiocyanate, 97%, Thermo Scientific™

CAS: 337508-62-0 Molecular Formula: C7H3N3S2 Molecular Weight (g/mol): 193.242 MDL Number: MFCD02681895 InChI Key: HHDWFDQYUFKNCO-UHFFFAOYSA-N PubChem CID: 2776292 IUPAC Name: 5-isothiocyanato-2,1,3-benzothiadiazole SMILES: C1=CC2=NSN=C2C=C1N=C=S

PubChem CID 2776292
CAS 337508-62-0
Molecular Weight (g/mol) 193.242
MDL Number MFCD02681895
SMILES C1=CC2=NSN=C2C=C1N=C=S
IUPAC Name 5-isothiocyanato-2,1,3-benzothiadiazole
InChI Key HHDWFDQYUFKNCO-UHFFFAOYSA-N
Molecular Formula C7H3N3S2
20

5-Chlorobenzo-2,1,3-thiadiazole, 98%

CAS: 2207-32-1 Molecular Formula: C6H3ClN2S Molecular Weight (g/mol): 170.61 MDL Number: MFCD00174269 InChI Key: VRNJWKISMWDTAY-UHFFFAOYSA-N Synonym: 5-chlorobenzo c 1,2,5 thiadiazole,5-chlorobenzo-2,1,3-thiadiazole,2,1,3-benzothiadiazole, 5-chloro,5-chlorobenzo c 1,2,5-thiadiazole,acmc-1cipd,maybridge1_004942,5-chloranyl-2,1,3-benzothiadiazole,3-chloro-8-thia-7,9-diazabicyclo 4.3.0 nona-2,4,6,9-tetraene PubChem CID: 284123 IUPAC Name: 5-chloro-2,1,3-benzothiadiazole SMILES: ClC1=CC2=NSN=C2C=C1

PubChem CID 284123
CAS 2207-32-1
Molecular Weight (g/mol) 170.61
MDL Number MFCD00174269
SMILES ClC1=CC2=NSN=C2C=C1
Synonym 5-chlorobenzo c 1,2,5 thiadiazole,5-chlorobenzo-2,1,3-thiadiazole,2,1,3-benzothiadiazole, 5-chloro,5-chlorobenzo c 1,2,5-thiadiazole,acmc-1cipd,maybridge1_004942,5-chloranyl-2,1,3-benzothiadiazole,3-chloro-8-thia-7,9-diazabicyclo 4.3.0 nona-2,4,6,9-tetraene
IUPAC Name 5-chloro-2,1,3-benzothiadiazole
InChI Key VRNJWKISMWDTAY-UHFFFAOYSA-N
Molecular Formula C6H3ClN2S
21

4,7-Dibromo-2,1,3-benzothiadiazole, 97%

CAS: 15155-41-6 Molecular Formula: C6H2Br2N2S Molecular Weight (g/mol): 293.96 MDL Number: MFCD00658844 InChI Key: FEOWHLLJXAECMU-UHFFFAOYSA-N Synonym: 4,7-dibromobenzo c 1,2,5 thiadiazole,4,7-dibromo-2,1,3-benzothidiazole,4,7-dibromobenzo c-1,2,5-thiadiazole,2,1,3-benzothiadiazole, 4,7-dibromo,acmc-1bu18,ksc490o9b,4,7-dibromobenzo 1,2,5 thiadiazole,4,7-dibromobenzo 2,1,3 thiadiazole,4,7-dibromo-2,1,3-benzothiadiazole,4,7-dibromo-benzo 1,2,5 thiadiazole PubChem CID: 626361 IUPAC Name: 4,7-dibromo-2,1,3-benzothiadiazole SMILES: BrC1=CC=C(Br)C2=NSN=C12

PubChem CID 626361
CAS 15155-41-6
Molecular Weight (g/mol) 293.96
MDL Number MFCD00658844
SMILES BrC1=CC=C(Br)C2=NSN=C12
Synonym 4,7-dibromobenzo c 1,2,5 thiadiazole,4,7-dibromo-2,1,3-benzothidiazole,4,7-dibromobenzo c-1,2,5-thiadiazole,2,1,3-benzothiadiazole, 4,7-dibromo,acmc-1bu18,ksc490o9b,4,7-dibromobenzo 1,2,5 thiadiazole,4,7-dibromobenzo 2,1,3 thiadiazole,4,7-dibromo-2,1,3-benzothiadiazole,4,7-dibromo-benzo 1,2,5 thiadiazole
IUPAC Name 4,7-dibromo-2,1,3-benzothiadiazole
InChI Key FEOWHLLJXAECMU-UHFFFAOYSA-N
Molecular Formula C6H2Br2N2S
22

4,7-Bis(5-bromo-4-n-octyl-2-thienyl)-2,1,3-benzothiadiazole 97.0+%, TCI America™
SDP

CAS: 457931-23-6 Molecular Formula: C30H38Br2N2S3 Molecular Weight (g/mol): 682.636 InChI Key: AMYLTENEOQNKGO-UHFFFAOYSA-N PubChem CID: 102243665 IUPAC Name: 4,7-bis(5-bromo-4-octylthiophen-2-yl)-2,1,3-benzothiadiazole SMILES: CCCCCCCCC1=C(SC(=C1)C2=CC=C(C3=NSN=C23)C4=CC(=C(S4)Br)CCCCCCCC)Br

PubChem CID 102243665
CAS 457931-23-6
Molecular Weight (g/mol) 682.636
SMILES CCCCCCCCC1=C(SC(=C1)C2=CC=C(C3=NSN=C23)C4=CC(=C(S4)Br)CCCCCCCC)Br
IUPAC Name 4,7-bis(5-bromo-4-octylthiophen-2-yl)-2,1,3-benzothiadiazole
InChI Key AMYLTENEOQNKGO-UHFFFAOYSA-N
Molecular Formula C30H38Br2N2S3
23

5,6-Dibromo-2,1,3-benzothiadiazole 98.0+%, TCI America™
SDP

CAS: 18392-81-9 Molecular Formula: C6H2Br2N2S Molecular Weight (g/mol): 293.96 MDL Number: MFCD20257910 InChI Key: XIDGOHYQUCNHTL-UHFFFAOYSA-N PubChem CID: 11044589 IUPAC Name: 5,6-dibromo-2,1,3-benzothiadiazole SMILES: BrC1=CC2=NSN=C2C=C1Br

PubChem CID 11044589
CAS 18392-81-9
Molecular Weight (g/mol) 293.96
MDL Number MFCD20257910
SMILES BrC1=CC2=NSN=C2C=C1Br
IUPAC Name 5,6-dibromo-2,1,3-benzothiadiazole
InChI Key XIDGOHYQUCNHTL-UHFFFAOYSA-N
Molecular Formula C6H2Br2N2S
24

5,6-Bis(n-octyloxy)-2,1,3-benzothiadiazole 98.0+%, TCI America™
SDP

CAS: 1254353-37-1 Molecular Formula: C22H36N2O2S Molecular Weight (g/mol): 392.60 MDL Number: MFCD19440987 InChI Key: GNYCNFWCQGDJRG-UHFFFAOYSA-N PubChem CID: 71614382 IUPAC Name: 5,6-bis(octyloxy)-2,1,3-benzothiadiazole SMILES: CCCCCCCCOC1=CC2=NSN=C2C=C1OCCCCCCCC

PubChem CID 71614382
CAS 1254353-37-1
Molecular Weight (g/mol) 392.60
MDL Number MFCD19440987
SMILES CCCCCCCCOC1=CC2=NSN=C2C=C1OCCCCCCCC
IUPAC Name 5,6-bis(octyloxy)-2,1,3-benzothiadiazole
InChI Key GNYCNFWCQGDJRG-UHFFFAOYSA-N
Molecular Formula C22H36N2O2S
25

4-Amino-2,1,3-benzothiadiazole 98.0+%, TCI America™
SDP

CAS: 767-64-6 Molecular Formula: C6H5N3S Molecular Weight (g/mol): 151.187 MDL Number: MFCD00005810 InChI Key: DRLGIZIAMHIQHL-UHFFFAOYSA-N Synonym: 4-aminobenzo-2,1,3-thiadiazole,4-amino-2,1,3-benzothiadiazole,4-aminopiazthiole,benzo c 1,2,5 thiadiazol-4-amine,2,1,3-benzothiadiazole, 4-amino,7-amino-2,1,3-benzothiadiazole,benzo 1,2,5 thiadiazol-4-ylamine,2,1,3-benzothiadiazole, 7-amino,2,1,3-benzothiadiazol-4-ylamine,2,1,3-benzothiadiazol-4 1h-imine PubChem CID: 69845 IUPAC Name: 2,1,3-benzothiadiazol-4-amine SMILES: C1=CC2=NSN=C2C(=C1)N

PubChem CID 69845
CAS 767-64-6
Molecular Weight (g/mol) 151.187
MDL Number MFCD00005810
SMILES C1=CC2=NSN=C2C(=C1)N
Synonym 4-aminobenzo-2,1,3-thiadiazole,4-amino-2,1,3-benzothiadiazole,4-aminopiazthiole,benzo c 1,2,5 thiadiazol-4-amine,2,1,3-benzothiadiazole, 4-amino,7-amino-2,1,3-benzothiadiazole,benzo 1,2,5 thiadiazol-4-ylamine,2,1,3-benzothiadiazole, 7-amino,2,1,3-benzothiadiazol-4-ylamine,2,1,3-benzothiadiazol-4 1h-imine
IUPAC Name 2,1,3-benzothiadiazol-4-amine
InChI Key DRLGIZIAMHIQHL-UHFFFAOYSA-N
Molecular Formula C6H5N3S
26

4,7-Dibromo-5,6-di-n-octyloxy-2,1,3-benzothiadiazole 98.0+%, TCI America™
SDP

CAS: 1192352-08-1 Molecular Formula: C22H34Br2N2O2S Molecular Weight (g/mol): 550.394 MDL Number: MFCD19940667 InChI Key: VGCVJZVDAAWTFC-UHFFFAOYSA-N PubChem CID: 67329181 IUPAC Name: 4,7-dibromo-5,6-dioctoxy-2,1,3-benzothiadiazole SMILES: CCCCCCCCOC1=C(C2=NSN=C2C(=C1OCCCCCCCC)Br)Br

PubChem CID 67329181
CAS 1192352-08-1
Molecular Weight (g/mol) 550.394
MDL Number MFCD19940667
SMILES CCCCCCCCOC1=C(C2=NSN=C2C(=C1OCCCCCCCC)Br)Br
IUPAC Name 4,7-dibromo-5,6-dioctoxy-2,1,3-benzothiadiazole
InChI Key VGCVJZVDAAWTFC-UHFFFAOYSA-N
Molecular Formula C22H34Br2N2O2S
27

4-Amino-5-chloro-2,1,3-benzothiadiazole 97.0+%, TCI America™
SDP

CAS: 30536-19-7 Molecular Formula: C6H4ClN3S Molecular Weight (g/mol): 185.629 MDL Number: MFCD00465908 InChI Key: MURNIACGGUSMAP-UHFFFAOYSA-N Synonym: 4-Amino-5-chloropiazthiole PubChem CID: 771620 IUPAC Name: 5-chloro-2,1,3-benzothiadiazol-4-amine SMILES: C1=CC2=NSN=C2C(=C1Cl)N

PubChem CID 771620
CAS 30536-19-7
Molecular Weight (g/mol) 185.629
MDL Number MFCD00465908
SMILES C1=CC2=NSN=C2C(=C1Cl)N
Synonym 4-Amino-5-chloropiazthiole
IUPAC Name 5-chloro-2,1,3-benzothiadiazol-4-amine
InChI Key MURNIACGGUSMAP-UHFFFAOYSA-N
Molecular Formula C6H4ClN3S
28

4-Nitro-2,1,3-benzothiadiazole 98.0+%, TCI America™
SDP

CAS: 6583-06-8 Molecular Formula: C6H3N3O2S Molecular Weight (g/mol): 181.17 MDL Number: MFCD00068050 InChI Key: IWQKAMJGVIHECB-UHFFFAOYSA-N Synonym: 4-nitrobenzo c 1,2,5 thiadiazole,4-nitropiazthiole,2,1,3-benzothiadiazole, 4-nitro,4-nitro-1,2,3-benzothiadiazole,4-nitro-benzo 1,2,5 thiadiazole,4-nitro-2??,1,3-benzothiadiazole,4-nitrobenzo c 1,2,5-thiadiazole,d0v8fg,acmc-1b59l,4-bromo-2,8-dimethylphenol PubChem CID: 81062 IUPAC Name: 4-nitro-2,1,3-benzothiadiazole SMILES: C1=CC2=NSN=C2C(=C1)[N+](=O)[O-]

PubChem CID 81062
CAS 6583-06-8
Molecular Weight (g/mol) 181.17
MDL Number MFCD00068050
SMILES C1=CC2=NSN=C2C(=C1)[N+](=O)[O-]
Synonym 4-nitrobenzo c 1,2,5 thiadiazole,4-nitropiazthiole,2,1,3-benzothiadiazole, 4-nitro,4-nitro-1,2,3-benzothiadiazole,4-nitro-benzo 1,2,5 thiadiazole,4-nitro-2??,1,3-benzothiadiazole,4-nitrobenzo c 1,2,5-thiadiazole,d0v8fg,acmc-1b59l,4-bromo-2,8-dimethylphenol
IUPAC Name 4-nitro-2,1,3-benzothiadiazole
InChI Key IWQKAMJGVIHECB-UHFFFAOYSA-N
Molecular Formula C6H3N3O2S
29

4,7-Bis(5-trimethylstannyl-2-thienyl)-2,1,3-benzothiadiazole 95.0+%, TCI America™
SDP

CAS: 1025451-57-3 Molecular Formula: C20H24N2S3Sn2 Molecular Weight (g/mol): 626.026 InChI Key: INHYKPMJJAWZKY-UHFFFAOYSA-N PubChem CID: 58153009 IUPAC Name: trimethyl-[5-[4-(5-trimethylstannylthiophen-2-yl)-2,1,3-benzothiadiazol-7-yl]thiophen-2-yl]stannane SMILES: C[Sn](C)(C)C1=CC=C(S1)C2=CC=C(C3=NSN=C23)C4=CC=C(S4)[Sn](C)(C)C

PubChem CID 58153009
CAS 1025451-57-3
Molecular Weight (g/mol) 626.026
SMILES C[Sn](C)(C)C1=CC=C(S1)C2=CC=C(C3=NSN=C23)C4=CC=C(S4)[Sn](C)(C)C
IUPAC Name trimethyl-[5-[4-(5-trimethylstannylthiophen-2-yl)-2,1,3-benzothiadiazol-7-yl]thiophen-2-yl]stannane
InChI Key INHYKPMJJAWZKY-UHFFFAOYSA-N
Molecular Formula C20H24N2S3Sn2
30

4,7-Bis(5-bromo-4-dodecyl-2-thienyl)-2,1,3-benzothiadiazole 98.0+%, TCI America™
SDP

CAS: 1179993-72-6 Molecular Formula: C38H54Br2N2S3 Molecular Weight (g/mol): 794.85 MDL Number: MFCD27923036 InChI Key: ZFMZIVKXDPTWBS-UHFFFAOYSA-N PubChem CID: 59609199 IUPAC Name: 4,7-bis(5-bromo-4-dodecylthiophen-2-yl)-2,1,3-benzothiadiazole SMILES: CCCCCCCCCCCCC1=C(Br)SC(=C1)C1=CC=C(C2=CC(CCCCCCCCCCCC)=C(Br)S2)C2=NSN=C12

PubChem CID 59609199
CAS 1179993-72-6
Molecular Weight (g/mol) 794.85
MDL Number MFCD27923036
SMILES CCCCCCCCCCCCC1=C(Br)SC(=C1)C1=CC=C(C2=CC(CCCCCCCCCCCC)=C(Br)S2)C2=NSN=C12
IUPAC Name 4,7-bis(5-bromo-4-dodecylthiophen-2-yl)-2,1,3-benzothiadiazole
InChI Key ZFMZIVKXDPTWBS-UHFFFAOYSA-N
Molecular Formula C38H54Br2N2S3