phenyl 2-[2-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]benzimidazol-1-yl]ethanesulfonate

Systemtic Name: phenyl 2-[2-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]benzimidazol-1-yl]ethanesulfonate Openeye Name: phenyl 2-[2-[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]benzimidazol-1-yl]ethanesulfonate CAS Name: 2-[2-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-1-benzimidazolyl]ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-[2-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzimidazol-1-yl]ethanesulfonate Traditional Name: 2-[2-[2-[(4-chlorobenzyl)amino]-2-keto-ethyl]benzimidazol-1-yl]ethanesulfonic acid phenyl ester Formula: C24H22ClN3O4S MolecularWeight: 483.96718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)CCN2C3=CC=CC=C3N=C2CC(=O)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)CCN2C3=CC=CC=C3N=C2CC(=O)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H22ClN3O4S/c25-19-12-10-18(11-13-19)17-26-24(29)16-23-27-21-8-4-5-9-22(21)28(23)14-15-33(30,31)32-20-6-2-1-3-7-20/h1-13H,14-17H2,(H,26,29)