2-[4-(1,3-benzothiazol-6-ylcarbamoyl)phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[4-(1,3-benzothiazol-6-ylcarbamoyl)phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-(1,3-benzothiazol-6-ylcarbamoyl)phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[4-[(1,3-benzothiazol-6-ylamino)-oxomethyl]phenyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[4-(1,3-benzothiazol-6-ylcarbamoyl)phenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[4-(1,3-benzothiazol-6-ylcarbamoyl)phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C28H24N4O3S MolecularWeight: 496.58016

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)C(=O)NC5=CC6=C(C=C5)N=CS6

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)C(=O)NC5=CC6=C(C=C5)N=CS6

InChI

InChI=1S/C28H24N4O3S/c33-27(30-20-11-12-22-25(15-20)36-16-29-22)18-8-6-17(7-9-18)26-31-23-14-19(28(34)35)10-13-24(23)32(26)21-4-2-1-3-5-21/h6-16,21H,1-5H2,(H,30,33)(H,34,35)