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

Systemtic Name: [2-[(2-fluorophenyl)carbamoylamino]-3H-benzimidazol-5-yl] 4-(cyclopentylamino)benzenesulfonate Openeye Name: [2-[(2-fluorophenyl)carbamoylamino]-3H-benzimidazol-5-yl] 4-(cyclopentylamino)benzenesulfonate CAS Name: 4-(cyclopentylamino)benzenesulfonic acid [2-[[(2-fluoroanilino)-oxomethyl]amino]-3H-benzimidazol-5-yl] ester IUPAC Name: [2-[(2-fluorophenyl)carbamoylamino]-3H-benzimidazol-5-yl] 4-(cyclopentylamino)benzenesulfonate Traditional Name: 4-(cyclopentylamino)benzenesulfonic acid [2-[(2-fluorophenyl)carbamoylamino]-3H-benzimidazol-5-yl] ester Formula: C25H24FN5O4S MolecularWeight: 509.552563

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=CC=C(C=C2)S(=O)(=O)OC3=CC4=C(C=C3)N=C(N4)NC(=O)NC5=CC=CC=C5F

Isomeric SMILES

C1CCC(C1)NC2=CC=C(C=C2)S(=O)(=O)OC3=CC4=C(C=C3)N=C(N4)NC(=O)NC5=CC=CC=C5F

InChI

InChI=1S/C25H24FN5O4S/c26-20-7-3-4-8-21(20)30-25(32)31-24-28-22-14-11-18(15-23(22)29-24)35-36(33,34)19-12-9-17(10-13-19)27-16-5-1-2-6-16/h3-4,7-16,27H,1-2,5-6H2,(H3,28,29,30,31,32)