(phenylmethyl) 2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]-3-phenyl-propanoate

Systemtic Name: (phenylmethyl) 2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]-3-phenyl-propanoate Openeye Name: benzyl 2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]-3-phenyl-propanoate CAS Name: 2-[[4-[(2-methyl-1-benzimidazolyl)methyl]phenyl]sulfonylamino]-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]-3-phenylpropanoate Traditional Name: 2-[[4-[(2-methylbenzimidazol-1-yl)methyl]phenyl]sulfonylamino]-3-phenyl-propionic acid benzyl ester Formula: C31H29N3O4S MolecularWeight: 539.64466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)S(=O)(=O)NC(CC4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)S(=O)(=O)NC(CC4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C31H29N3O4S/c1-23-32-28-14-8-9-15-30(28)34(23)21-25-16-18-27(19-17-25)39(36,37)33-29(20-24-10-4-2-5-11-24)31(35)38-22-26-12-6-3-7-13-26/h2-19,29,33H,20-22H2,1H3