[2-[(4-methoxyphenyl)carbamoylamino]-3H-benzimidazol-5-yl] 4-(cyclopentylamino)benzenesulfonate

Systemtic Name: [2-[(4-methoxyphenyl)carbamoylamino]-3H-benzimidazol-5-yl] 4-(cyclopentylamino)benzenesulfonate Openeye Name: [2-[(4-methoxyphenyl)carbamoylamino]-3H-benzimidazol-5-yl] 4-(cyclopentylamino)benzenesulfonate CAS Name: 4-(cyclopentylamino)benzenesulfonic acid [2-[[(4-methoxyanilino)-oxomethyl]amino]-3H-benzimidazol-5-yl] ester IUPAC Name: [2-[(4-methoxyphenyl)carbamoylamino]-3H-benzimidazol-5-yl] 4-(cyclopentylamino)benzenesulfonate Traditional Name: 4-(cyclopentylamino)benzenesulfonic acid [2-[(4-methoxyphenyl)carbamoylamino]-3H-benzimidazol-5-yl] ester Formula: C26H27N5O5S MolecularWeight: 521.58808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NC2=NC3=C(N2)C=C(C=C3)OS(=O)(=O)C4=CC=C(C=C4)NC5CCCC5

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NC2=NC3=C(N2)C=C(C=C3)OS(=O)(=O)C4=CC=C(C=C4)NC5CCCC5

InChI

InChI=1S/C26H27N5O5S/c1-35-20-10-6-19(7-11-20)28-26(32)31-25-29-23-15-12-21(16-24(23)30-25)36-37(33,34)22-13-8-18(9-14-22)27-17-4-2-3-5-17/h6-17,27H,2-5H2,1H3,(H3,28,29,30,31,32)