[5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 3-chloranyl-1H-indole-2-carboxylate

Systemtic Name: [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 3-chloranyl-1H-indole-2-carboxylate Openeye Name: [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl 3-chloro-1H-indole-2-carboxylate CAS Name: 3-chloro-1H-indole-2-carboxylic acid [5-(dimethylsulfamoyl)-1-propyl-2-benzimidazolyl]methyl ester IUPAC Name: [5-(dimethylsulfamoyl)-1-propylbenzimidazol-2-yl]methyl 3-chloro-1H-indole-2-carboxylate Traditional Name: 3-chloro-1H-indole-2-carboxylic acid [5-(dimethylsulfamoyl)-1-propyl-benzimidazol-2-yl]methyl ester Formula: C22H23ClN4O4S MolecularWeight: 474.96042

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)C3=C(C4=CC=CC=C4N3)Cl

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)C3=C(C4=CC=CC=C4N3)Cl

InChI

InChI=1S/C22H23ClN4O4S/c1-4-11-27-18-10-9-14(32(29,30)26(2)3)12-17(18)24-19(27)13-31-22(28)21-20(23)15-7-5-6-8-16(15)25-21/h5-10,12,25H,4,11,13H2,1-3H3