N-(cyanomethyl)-2-[(phenylmethyl)sulfonylmethyl]-3-(3-phenylphenyl)propanamide

Systemtic Name: N-(cyanomethyl)-2-[(phenylmethyl)sulfonylmethyl]-3-(3-phenylphenyl)propanamide Openeye Name: 2-(benzylsulfonylmethyl)-N-(cyanomethyl)-3-(3-phenylphenyl)propanamide CAS Name: N-(cyanomethyl)-2-[(phenylmethyl)sulfonylmethyl]-3-(3-phenylphenyl)propanamide IUPAC Name: 2-(benzylsulfonylmethyl)-N-(cyanomethyl)-3-(3-phenylphenyl)propanamide Traditional Name: 2-(benzylsulfonylmethyl)-N-(cyanomethyl)-3-(3-phenylphenyl)propionamide Formula: C25H24N2O3S MolecularWeight: 432.53466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)CC(CC2=CC=CC(=C2)C3=CC=CC=C3)C(=O)NCC#N

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)CC(CC2=CC=CC(=C2)C3=CC=CC=C3)C(=O)NCC#N

InChI

InChI=1S/C25H24N2O3S/c26-14-15-27-25(28)24(19-31(29,30)18-20-8-3-1-4-9-20)17-21-10-7-13-23(16-21)22-11-5-2-6-12-22/h1-13,16,24H,15,17-19H2,(H,27,28)