Benzene and substituted derivatives
Chlorpropamide
CAS: 94-20-2 Molecular Formula: C10H13ClN2O3S Molecular Weight (g/mol): 276.735 MDL Number: MFCD00079004 InChI Key: RKWGIWYCVPQPMF-UHFFFAOYSA-N Synonym: chlorpropamide,chloropropamide,diabinese,chlorpropamid,diabenese,glucamide,meldian,chlorodiabina,chloronase,diabeneza PubChem CID: 2727 ChEBI: CHEBI:3650 IUPAC Name: 1-(4-chlorophenyl)sulfonyl-3-propylurea SMILES: CCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)Cl
2,4-Dimethoxybenzenesulfonamide, 96%
CAS: 51770-71-9 Molecular Formula: C8H11NO4S Molecular Weight (g/mol): 217.24 MDL Number: MFCD06147001 InChI Key: MGHCDRVTMABICG-UHFFFAOYSA-N Synonym: 2,4-dimethoxybenzene-1-sulfonamide,benzenesulfonamide,2,4-dimethoxy PubChem CID: 6469795 IUPAC Name: 2,4-dimethoxybenzenesulfonamide SMILES: COC1=CC(OC)=C(C=C1)S(N)(=O)=O
2-(Methoxycarbonyl)benzenesulfonamide, 98%
CAS: 57683-71-3 Molecular Formula: C8H9NO4S Molecular Weight (g/mol): 215.22 MDL Number: MFCD00009808 InChI Key: VSOOBQALJVLTBH-UHFFFAOYSA-N Synonym: methyl 2-aminosulfonyl benzoate,2-carbomethoxybenzenesulfonamide,2-sulfamoylbenzoic acid methyl ester,2-methoxycarbonyl benzene sulfonamide,methyl o-sulphamoylbenzoate,benzoic acid, 2-aminosulfonyl-, methyl ester,benzoic acid, 2-sulfamoyl-, methyl ester,2-methoxycarbonylphenylsulfonamide,2-methoxycarbonylbenzenesulfonamide,2-methoxycarbonyl benzenesulphonamide PubChem CID: 42546 ChEBI: CHEBI:83512 IUPAC Name: methyl 2-sulfamoylbenzoate SMILES: COC(=O)C1=CC=CC=C1S(N)(=O)=O
4-Chlorobenzenesulfonamide, 98+%
CAS: 98-64-6 Molecular Formula: C6H6ClNO2S Molecular Weight (g/mol): 191.63 MDL Number: MFCD00007936 InChI Key: HHHDJHHNEURCNV-UHFFFAOYSA-N Synonym: p-chlorobenzenesulfonamide,benzenesulfonamide, 4-chloro,p-chlorobenzenesulfamide,4-chlorophenylsulfonamide,p-chlorophenylsulfonamide,4-chlorobenzenesulphonamide,benzenesulfonamide, p-chloro,usaf ma-3,4-chlorobenzene-1-sulfonamide,4-chloro-benzenesulfonamide PubChem CID: 66824 IUPAC Name: 4-chlorobenzenesulfonamide SMILES: NS(=O)(=O)C1=CC=C(Cl)C=C1
Indapamide
CAS: 26807-65-8 Molecular Formula: C16H16ClN3O3S Molecular Weight (g/mol): 365.83 MDL Number: MFCD00079375 InChI Key: NDDAHWYSQHTHNT-UHFFFAOYNA-N Synonym: indapamide,noranat,veroxil,tertensif,arifon,fludex,lozol,indaflex,bajaten,indamol PubChem CID: 3702 ChEBI: CHEBI:5893 IUPAC Name: 4-chloro-N-(2-methyl-2,3-dihydro-1H-indol-1-yl)-3-sulfamoylbenzamide SMILES: CC1CC2=CC=CC=C2N1NC(=O)C1=CC=C(Cl)C(=C1)S(N)(=O)=O
3-Phenylsulfonamidopyridine-5-boronic acid pinacol ester, 96%, Thermo Scientific Chemicals
CAS: 1083326-28-6 Molecular Formula: C17H21BN2O4S Molecular Weight (g/mol): 360.235 MDL Number: MFCD13190589 InChI Key: UXJVHVXONVGHIL-UHFFFAOYSA-N Synonym: n-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridin-3-yl benzenesulfonamide,3-phenylsulfonamidopyridine-5-boronic acid pinacol ester,n-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-3-pyridinyl benzenesulfonamide,n-5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridin-3-yl benzenesulfonamide,n-5-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl pyridin-3-yl benzenesulfonamide PubChem CID: 52936632 IUPAC Name: N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]benzenesulfonamide SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CN=C2)NS(=O)(=O)C3=CC=CC=C3
3,5-Dimethoxy-4-methylbenzoic acid, 97%
CAS: 61040-81-1 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.202 MDL Number: MFCD00017506 InChI Key: QIBMVRYNEXOCCF-UHFFFAOYSA-N Synonym: 3,5-dimethoxy-4-methyl-benzoic acid,benzoic acid,3,5-dimethoxy-4-methyl,3,5-dimethoxy-4-methylbenzoicacid,acmc-1b58y,3,5-dimethoxy4-methylbenzoic acid,4-methyl-3,5-dimethoxybenzoic acid,3,5-dimethoxy-p-toluic acid,labotest-bb lt00455447,3,5-dimethoxy-4-methyl benzoic acid,3,5-di-methoxy-4-methyl-benzoic acid PubChem CID: 3764486 IUPAC Name: 3,5-dimethoxy-4-methylbenzoic acid SMILES: CC1=C(C=C(C=C1OC)C(=O)O)OC
Methyl vanillate, 99%
CAS: 3943-74-6 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.18 MDL Number: MFCD00008438 InChI Key: BVWTXUYLKBHMOX-UHFFFAOYSA-N Synonym: methyl vanillate,methyl 3-methoxy-4-hydroxybenzoate,vanillic acid, methyl ester,4-hydroxy-3-methoxybenzoic acid methyl ester,methylvanillate,benzoic acid, 4-hydroxy-3-methoxy-, methyl ester,vanillic acid methyl ester,unii-2hxg8qso3d,2hxg8qso3d,vxx PubChem CID: 19844 ChEBI: CHEBI:46477 IUPAC Name: methyl 4-hydroxy-3-methoxybenzoate SMILES: COC1=C(C=CC(=C1)C(=O)OC)O
2-Amino-4,5-dimethoxybenzoic acid, 98%
CAS: 5653-40-7 Molecular Formula: C9H11NO4 Molecular Weight (g/mol): 197.19 MDL Number: MFCD00011671 InChI Key: HJVAVGOPTDJYOJ-UHFFFAOYSA-N Synonym: 4,5-dimethoxyanthranilic acid,6-aminoveratric acid,benzoic acid, 2-amino-4,5-dimethoxy,2-amino-4,5-dimethoxy benzoic acid,2-amino-4,5-dimethoxy-benzoic acid,6-aminoveratricacid,zlchem 238,pubchem3110,acmc-1b03r,ksc269i1n PubChem CID: 79736 IUPAC Name: 2-amino-4,5-dimethoxybenzoic acid SMILES: COC1=CC(N)=C(C=C1OC)C(O)=O
2-Hydroxy-3-methoxybenzoic acid, 98+%
CAS: 877-22-5 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.15 MDL Number: MFCD00002445 InChI Key: AUZQQIPZESHNMG-UHFFFAOYSA-N Synonym: 3-methoxysalicylic acid,o-vanillic acid,acide orthovanillique,benzoic acid, 2-hydroxy-3-methoxy,m-anisic acid, 2-hydroxy,3-hydroxy-m-anisic acid,unii-3j31y0e2im,2-hydroxy-3-methoxy-benzoic acid,3-methoxysalicyclic acid,2-hydroxy-3-methoxy benzoic acid PubChem CID: 70140 ChEBI: CHEBI:68496 IUPAC Name: 2-hydroxy-3-methoxybenzoic acid SMILES: COC1=CC=CC(C(O)=O)=C1O
Ethyl vanillate, 97%
CAS: 617-05-0 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.20 MDL Number: MFCD00017269 InChI Key: MWAYRGBWOVHDDZ-UHFFFAOYSA-N Synonym: ethyl vanillate,vanillic acid, ethyl ester,4-hydroxy-3-methoxybenzoic acid ethyl ester,benzoic acid, 4-hydroxy-3-methoxy-, ethyl ester,unii-v38jk4z93o,3-methoxy-4-hydroxybenzoic acid, ethyl ester,m-anisic acid, 4-hydroxy-, ethyl ester,vanilicacidethylester,ethyl 4-hydroxy-3-methoxy-benzoate,ethylvanillate PubChem CID: 12038 IUPAC Name: ethyl 4-hydroxy-3-methoxybenzoate SMILES: CCOC(=O)C1=CC=C(O)C(OC)=C1
4-(5-Methyl-1,3,4-oxadiazol-2-yl)benzaldehyde, 97%, Thermo Scientific™
CAS: 179056-82-7 Molecular Formula: C10H8N2O2 Molecular Weight (g/mol): 188.19 MDL Number: MFCD11109323 InChI Key: MPECIJQJPPLBGV-UHFFFAOYSA-N Synonym: 4-5-methyl-1,3,4-oxadiazol-2-yl benzaldehyde,2-4-formylphenyl-5-methyl-1,3,4-oxadiazole,benzaldehyde,4-5-methyl-1,3,4-oxadiazol-2-yl,4-5-methyl-1,3,4-oxadiazol-2-yl benzaldehyd,benzaldehyde, 4-5-methyl-1,3,4-oxadiazol-2-yl PubChem CID: 10655207 IUPAC Name: 4-(5-methyl-1,3,4-oxadiazol-2-yl)benzaldehyde SMILES: CC1=NN=C(O1)C1=CC=C(C=O)C=C1
3-Pyrimidin-2-ylbenzylamine, 97%, Thermo Scientific™
CAS: 910036-92-9 Molecular Formula: C11H11N3 Molecular Weight (g/mol): 185.23 MDL Number: MFCD09702384 InChI Key: MXSXDKVANPZCBQ-UHFFFAOYSA-N Synonym: 3-pyrimidin-2-ylbenzylamine,3-pyrimidin-2-yl phenyl methanamine,3-pyrimidin-2-yl benzylamine,1-3-pyrimidin-2-yl phenyl methanamine,3-pyrimidin-2-ylphenyl methylamine,benzenemethanamine, 3-2-pyrimidinyl PubChem CID: 24229566 IUPAC Name: (3-pyrimidin-2-ylphenyl)methanamine SMILES: NCC1=CC=CC(=C1)C1=NC=CC=N1
3-(Pyrrolidin-1-ylmethyl)benzaldehyde, 97%, Thermo Scientific™
CAS: 884507-42-0 Molecular Formula: C12H15NO Molecular Weight (g/mol): 189.26 MDL Number: MFCD07782420 InChI Key: XHHOLQHPKIDQEM-UHFFFAOYSA-N Synonym: 3-pyrrolidin-1-ylmethyl benzaldehyde,3-pyrrolidin-1-yl methyl benzaldehyde,benzaldehyde, 3-1-pyrrolidinylmethyl,1-3-formylbenzyl pyrrolidine,3-pyrrolidinylmethyl benzaldehyde,3-pyrrolidin-1-ylmethyl-benzaldehyde PubChem CID: 18525870 IUPAC Name: 3-(pyrrolidin-1-ylmethyl)benzaldehyde SMILES: O=CC1=CC(CN2CCCC2)=CC=C1