Indoles and derivatives

Aromatic bicyclic organic compounds that consists of a benzene ring fused to a pyrrole ring with formula: C₈H₇N.

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Thermo Scientific Chemicals Indomethacin

CAS: 53-86-1 Molecular Formula: C₁₉H₁₆ClNO₄ Molecular Weight (g/mol): 357.79 InChI Key: CGIGDMFJXJATDK-UHFFFAOYSA-N Synonym: indomethacin,indometacin,indocin,indometacine,indomethacine,indocid,metindol,amuno,indomethazine,imbrilon PubChem CID: 3715 ChEBI: CHEBI:49662 IUPAC Name: 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid SMILES: CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)O

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PubChem CID	3715
CAS	53-86-1
Molecular Weight (g/mol)	357.79
ChEBI	CHEBI:49662
SMILES	CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)O
Synonym	indomethacin,indometacin,indocin,indometacine,indomethacine,indocid,metindol,amuno,indomethazine,imbrilon
IUPAC Name	2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid
InChI Key	CGIGDMFJXJATDK-UHFFFAOYSA-N
Molecular Formula	C₁₉H₁₆ClNO₄

5-Hydroxyindole-3-Acetic Acid Analytical Standard, MilliporeSigma™ Supelco™

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Specifications

Percent Purity	≥98% (HPLC)
CAS	54-16-0
MDL Number	MFCD00005639
Synonym	5-HIAA
RTECS Number	NL3650000
Recommended Storage	-20°C
Grade	Analytical Standard
Shelf Life	Limited shelf life, expiry date on the label
Molecular Formula	C10H9NO3
Formula Weight	191.18
Melting Point	161°C to 164°C (literature)

Oncrasin 1 95.0+%, TCI America™

CAS: 75629-57-1 Molecular Formula: C16H12ClNO Molecular Weight (g/mol): 269.73 MDL Number: MFCD01051808 InChI Key: ZDRQMXCSSAPUMM-UHFFFAOYSA-N PubChem CID: 872445 IUPAC Name: 1-[(4-chlorophenyl)methyl]-1H-indole-3-carbaldehyde SMILES: ClC1=CC=C(CN2C=C(C=O)C3=CC=CC=C23)C=C1

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PubChem CID	872445
CAS	75629-57-1
Molecular Weight (g/mol)	269.73
MDL Number	MFCD01051808
SMILES	ClC1=CC=C(CN2C=C(C=O)C3=CC=CC=C23)C=C1
IUPAC Name	1-[(4-chlorophenyl)methyl]-1H-indole-3-carbaldehyde
InChI Key	ZDRQMXCSSAPUMM-UHFFFAOYSA-N
Molecular Formula	C16H12ClNO

2-(4-Amidinophenyl)indole-6-carboxamidine Dihydrochloride 90.0+%, TCI America™

CAS: 28718-90-3 Molecular Formula: C16H17Cl2N5 Molecular Weight (g/mol): 350.25 MDL Number: MFCD00012681 InChI Key: FPNZBYLXNYPRLR-UHFFFAOYSA-N Synonym: 4',6-diamidino-2-phenylindole dihydrochloride,dapi dihydrochloride,dapi, dihydrochloride,2-4-carbamimidoylphenyl-1h-indole-6-carboximidamide dihydrochloride,dapi hydrochloride,2-phenylindole-4',6-dicarboxamidine dihydrohydrochloride hydrate,2-4-amidinophenyl-6-indolecarbamidine dihydrochloride,4′,6-diamidino-2-phenylindole, 2hcl,ccris 8836 PubChem CID: 160166 IUPAC Name: dihydrogen 2-(4-carbamimidoylphenyl)-1H-indole-6-carboximidamide dichloride SMILES: [H+].[H+].[Cl-].[Cl-].NC(=N)C1=CC=C(C=C1)C1=CC2=CC=C(C=C2N1)C(N)=N

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PubChem CID	160166
CAS	28718-90-3
Molecular Weight (g/mol)	350.25
MDL Number	MFCD00012681
SMILES	[H+].[H+].[Cl-].[Cl-].NC(=N)C1=CC=C(C=C1)C1=CC2=CC=C(C=C2N1)C(N)=N
Synonym	4',6-diamidino-2-phenylindole dihydrochloride,dapi dihydrochloride,dapi, dihydrochloride,2-4-carbamimidoylphenyl-1h-indole-6-carboximidamide dihydrochloride,dapi hydrochloride,2-phenylindole-4',6-dicarboxamidine dihydrohydrochloride hydrate,2-4-amidinophenyl-6-indolecarbamidine dihydrochloride,4′,6-diamidino-2-phenylindole, 2hcl,ccris 8836
IUPAC Name	dihydrogen 2-(4-carbamimidoylphenyl)-1H-indole-6-carboximidamide dichloride
InChI Key	FPNZBYLXNYPRLR-UHFFFAOYSA-N
Molecular Formula	C16H17Cl2N5

Indometacin Farnesil 98.0+%, TCI America™

CAS: 85801-02-1 Molecular Formula: C34H40ClNO4 Molecular Weight (g/mol): 562.147 MDL Number: MFCD00870661 InChI Key: CFIGYZZVJNJVDQ-LMJOQDENSA-N PubChem CID: 5282183 IUPAC Name: [(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl] 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetate SMILES: CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)OCC=C(C)CCC=C(C)CCC=C(C)C

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PubChem CID	5282183
CAS	85801-02-1
Molecular Weight (g/mol)	562.147
MDL Number	MFCD00870661
SMILES	CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)OCC=C(C)CCC=C(C)CCC=C(C)C
IUPAC Name	[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl] 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetate
InChI Key	CFIGYZZVJNJVDQ-LMJOQDENSA-N
Molecular Formula	C34H40ClNO4

Carvedilol 98.0+%, TCI America™

CAS: 72956-09-3 Molecular Formula: C24H26N2O4 Molecular Weight (g/mol): 406.48 MDL Number: MFCD00864692,MFCD00869663 InChI Key: OGHNVEJMJSYVRP-UHFFFAOYNA-N Synonym: carvedilol,coreg,dilatrend,carvedilolum,eucardic,carvedilolum latin,kredex,querto,1-9h-carbazol-4-yloxy-3-2-2-methoxyphenoxy ethyl amino-2-propanol,1-9h-carbazol-4-yl oxy-3-2-2-methoxyphenoxy ethyl amino propan-2-ol PubChem CID: 2585 ChEBI: CHEBI:3441 IUPAC Name: 1-(9H-carbazol-4-yloxy)-3-{[2-(2-methoxyphenoxy)ethyl]amino}propan-2-ol SMILES: COC1=CC=CC=C1OCCNCC(O)COC1=CC=CC2=C1C1=C(N2)C=CC=C1

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PubChem CID	2585
CAS	72956-09-3
Molecular Weight (g/mol)	406.48
ChEBI	CHEBI:3441
MDL Number	MFCD00864692,MFCD00869663
SMILES	COC1=CC=CC=C1OCCNCC(O)COC1=CC=CC2=C1C1=C(N2)C=CC=C1
Synonym	carvedilol,coreg,dilatrend,carvedilolum,eucardic,carvedilolum latin,kredex,querto,1-9h-carbazol-4-yloxy-3-2-2-methoxyphenoxy ethyl amino-2-propanol,1-9h-carbazol-4-yl oxy-3-2-2-methoxyphenoxy ethyl amino propan-2-ol
IUPAC Name	1-(9H-carbazol-4-yloxy)-3-{[2-(2-methoxyphenoxy)ethyl]amino}propan-2-ol
InChI Key	OGHNVEJMJSYVRP-UHFFFAOYNA-N
Molecular Formula	C24H26N2O4

Indole-3-acetamide 98.0+%, TCI America™

CAS: 879-37-8 Molecular Formula: C10H10N2O Molecular Weight (g/mol): 174.20 MDL Number: MFCD00005641 InChI Key: ZOAMBXDOGPRZLP-UHFFFAOYSA-N PubChem CID: 397 ChEBI: CHEBI:16031 IUPAC Name: 2-(1H-indol-3-yl)acetamide SMILES: NC(=O)CC1=CNC2=CC=CC=C12

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Specifications

PubChem CID	397
CAS	879-37-8
Molecular Weight (g/mol)	174.20
ChEBI	CHEBI:16031
MDL Number	MFCD00005641
SMILES	NC(=O)CC1=CNC2=CC=CC=C12
IUPAC Name	2-(1H-indol-3-yl)acetamide
InChI Key	ZOAMBXDOGPRZLP-UHFFFAOYSA-N
Molecular Formula	C10H10N2O

Melatonin 98.0+%, TCI America™

CAS: 73-31-4 Molecular Formula: C13H16N2O2 Molecular Weight (g/mol): 232.283 MDL Number: MFCD00005655 InChI Key: DRLFMBDRBRZALE-UHFFFAOYSA-N Synonym: melatonin,melatonine,n-acetyl-5-methoxytryptamine,circadin,5-methoxy-n-acetyltryptamine,n-2-5-methoxy-1h-indol-3-yl ethyl acetamide,melatol,melatonex,melovine PubChem CID: 896 ChEBI: CHEBI:16796 IUPAC Name: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide SMILES: CC(=O)NCCC1=CNC2=C1C=C(C=C2)OC

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Specifications

PubChem CID	896
CAS	73-31-4
Molecular Weight (g/mol)	232.283
ChEBI	CHEBI:16796
MDL Number	MFCD00005655
SMILES	CC(=O)NCCC1=CNC2=C1C=C(C=C2)OC
Synonym	melatonin,melatonine,n-acetyl-5-methoxytryptamine,circadin,5-methoxy-n-acetyltryptamine,n-2-5-methoxy-1h-indol-3-yl ethyl acetamide,melatol,melatonex,melovine
IUPAC Name	N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
InChI Key	DRLFMBDRBRZALE-UHFFFAOYSA-N
Molecular Formula	C13H16N2O2

2,7-Dibromo-9-(4-bromophenyl)-9H-carbazole 98.0+%, TCI America™

CAS: 1313900-20-7 Molecular Formula: C18H10Br3N Molecular Weight (g/mol): 479.997 InChI Key: MKSHSKZVLIHXMT-UHFFFAOYSA-N PubChem CID: 129317820 IUPAC Name: 2,7-dibromo-9-(4-bromophenyl)carbazole SMILES: C1=CC(=CC=C1N2C3=C(C=CC(=C3)Br)C4=C2C=C(C=C4)Br)Br

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Specifications

PubChem CID	129317820
CAS	1313900-20-7
Molecular Weight (g/mol)	479.997
SMILES	C1=CC(=CC=C1N2C3=C(C=CC(=C3)Br)C4=C2C=C(C=C4)Br)Br
IUPAC Name	2,7-dibromo-9-(4-bromophenyl)carbazole
InChI Key	MKSHSKZVLIHXMT-UHFFFAOYSA-N
Molecular Formula	C18H10Br3N

3,6-Dibromo-9-(4-methoxyphenyl)-9H-carbazole 98.0+%, TCI America™

CAS: 746651-52-5 Molecular Formula: C19H13Br2NO Molecular Weight (g/mol): 431.127 InChI Key: YXWHLCSWBLHWCH-UHFFFAOYSA-N PubChem CID: 58620860 IUPAC Name: 3,6-dibromo-9-(4-methoxyphenyl)carbazole SMILES: COC1=CC=C(C=C1)N2C3=C(C=C(C=C3)Br)C4=C2C=CC(=C4)Br

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PubChem CID	58620860
CAS	746651-52-5
Molecular Weight (g/mol)	431.127
SMILES	COC1=CC=C(C=C1)N2C3=C(C=C(C=C3)Br)C4=C2C=CC(=C4)Br
IUPAC Name	3,6-dibromo-9-(4-methoxyphenyl)carbazole
InChI Key	YXWHLCSWBLHWCH-UHFFFAOYSA-N
Molecular Formula	C19H13Br2NO

4-Hydroxycarbazole 98.0+%, TCI America™

CAS: 52602-39-8 Molecular Formula: C12H9NO Molecular Weight (g/mol): 183.21 MDL Number: MFCD02178385 InChI Key: UEOHATPGKDSULR-UHFFFAOYSA-N Synonym: 4-hydroxycarbazole,4-hydroxy carbazole,ccris 5300,chembl46723,4-hydroxycarbazol,4-hydroxy-carbazole,pubchem9190,4-hydroxy-9h-carbazole,acmc-209l0g PubChem CID: 104251 IUPAC Name: 9H-carbazol-4-ol SMILES: C1=CC=C2C(=C1)C3=C(N2)C=CC=C3O

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PubChem CID	104251
CAS	52602-39-8
Molecular Weight (g/mol)	183.21
MDL Number	MFCD02178385
SMILES	C1=CC=C2C(=C1)C3=C(N2)C=CC=C3O
Synonym	4-hydroxycarbazole,4-hydroxy carbazole,ccris 5300,chembl46723,4-hydroxycarbazol,4-hydroxy-carbazole,pubchem9190,4-hydroxy-9h-carbazole,acmc-209l0g
IUPAC Name	9H-carbazol-4-ol
InChI Key	UEOHATPGKDSULR-UHFFFAOYSA-N
Molecular Formula	C12H9NO

9-Ethylcarbazole-3-carboxaldehyde N-Methyl-N-phenylhydrazone 98.0+%, TCI America™

CAS: 75232-44-9 Molecular Formula: C22H21N3 Molecular Weight (g/mol): 327.431 MDL Number: MFCD00799310 InChI Key: QYXUHIZLHNDFJT-XQNSMLJCSA-N Synonym: 9-Ethyl-3-(N-methyl-N-phenylhydrazonomethyl)carbazole PubChem CID: 9610378 IUPAC Name: N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]-N-methylaniline SMILES: CCN1C2=C(C=C(C=C2)C=NN(C)C3=CC=CC=C3)C4=CC=CC=C41

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Specifications

PubChem CID	9610378
CAS	75232-44-9
Molecular Weight (g/mol)	327.431
MDL Number	MFCD00799310
SMILES	CCN1C2=C(C=C(C=C2)C=NN(C)C3=CC=CC=C3)C4=CC=CC=C41
Synonym	9-Ethyl-3-(N-methyl-N-phenylhydrazonomethyl)carbazole
IUPAC Name	N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]-N-methylaniline
InChI Key	QYXUHIZLHNDFJT-XQNSMLJCSA-N
Molecular Formula	C22H21N3

2,6-Bis[3-(9H-carbazol-9-yl)phenyl]pyridine 98.0+%, TCI America™

CAS: 1013405-24-7 Molecular Formula: C41H27N3 Molecular Weight (g/mol): 561.688 MDL Number: MFCD20275106 InChI Key: UFWDOFZYKRDHPB-UHFFFAOYSA-N Synonym: DCzPPy PubChem CID: 59629380 IUPAC Name: 9-[3-[6-(3-carbazol-9-ylphenyl)pyridin-2-yl]phenyl]carbazole SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC=CC(=C4)C5=NC(=CC=C5)C6=CC(=CC=C6)N7C8=CC=CC=C8C9=CC=CC=C97

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Specifications

PubChem CID	59629380
CAS	1013405-24-7
Molecular Weight (g/mol)	561.688
MDL Number	MFCD20275106
SMILES	C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC=CC(=C4)C5=NC(=CC=C5)C6=CC(=CC=C6)N7C8=CC=CC=C8C9=CC=CC=C97
Synonym	DCzPPy
IUPAC Name	9-[3-[6-(3-carbazol-9-ylphenyl)pyridin-2-yl]phenyl]carbazole
InChI Key	UFWDOFZYKRDHPB-UHFFFAOYSA-N
Molecular Formula	C41H27N3

9-Ethylcarbazole-3-carboxaldehyde N-Ethyl-N-(o-tolyl)hydrazone 98.0+%, TCI America™

CAS: 1274948-12-7 Molecular Formula: C24H25N3 Molecular Weight (g/mol): 355.485 MDL Number: MFCD06797102 InChI Key: ZBZXBQAWGRIJEX-UQQQWYQISA-N Synonym: 9-Ethyl-3-[N-ethyl-N-(o-tolyl)hydrazonomethyl]carbazole PubChem CID: 93978907 IUPAC Name: N-ethyl-N-[(Z)-(9-ethylcarbazol-3-yl)methylideneamino]-2-methylaniline SMILES: CCN1C2=C(C=C(C=C2)C=NN(CC)C3=CC=CC=C3C)C4=CC=CC=C41

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Specifications

PubChem CID	93978907
CAS	1274948-12-7
Molecular Weight (g/mol)	355.485
MDL Number	MFCD06797102
SMILES	CCN1C2=C(C=C(C=C2)C=NN(CC)C3=CC=CC=C3C)C4=CC=CC=C41
Synonym	9-Ethyl-3-[N-ethyl-N-(o-tolyl)hydrazonomethyl]carbazole
IUPAC Name	N-ethyl-N-[(Z)-(9-ethylcarbazol-3-yl)methylideneamino]-2-methylaniline
InChI Key	ZBZXBQAWGRIJEX-UQQQWYQISA-N
Molecular Formula	C24H25N3

9-Ethylcarbazole-3-carboxaldehyde N-Ethyl-N-(m-tolyl)hydrazone 98.0+%, TCI America™

CAS: 81380-24-7 Molecular Formula: C24H25N3 Molecular Weight (g/mol): 355.485 MDL Number: MFCD06797103 InChI Key: VIRJEGJEGJEEDN-UQQQWYQISA-N Synonym: 9-Ethyl-3-[N-ethyl-N-(m-tolyl)hydrazonomethyl]carbazole PubChem CID: 93978908 IUPAC Name: N-ethyl-N-[(Z)-(9-ethylcarbazol-3-yl)methylideneamino]-3-methylaniline SMILES: CCN1C2=C(C=C(C=C2)C=NN(CC)C3=CC=CC(=C3)C)C4=CC=CC=C41

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Specifications

PubChem CID	93978908
CAS	81380-24-7
Molecular Weight (g/mol)	355.485
MDL Number	MFCD06797103
SMILES	CCN1C2=C(C=C(C=C2)C=NN(CC)C3=CC=CC(=C3)C)C4=CC=CC=C41
Synonym	9-Ethyl-3-[N-ethyl-N-(m-tolyl)hydrazonomethyl]carbazole
IUPAC Name	N-ethyl-N-[(Z)-(9-ethylcarbazol-3-yl)methylideneamino]-3-methylaniline
InChI Key	VIRJEGJEGJEEDN-UQQQWYQISA-N
Molecular Formula	C24H25N3

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