N-[2-[bis(phenylmethyl)amino]-1-cyano-3-phenyl-propyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-[bis(phenylmethyl)amino]-1-cyano-3-phenyl-propyl]-4-methyl-benzenesulfonamide Openeye Name: N-[1-cyano-2-(dibenzylamino)-3-phenyl-propyl]-4-methyl-benzenesulfonamide CAS Name: N-[2-[bis(phenylmethyl)amino]-1-cyano-3-phenylpropyl]-4-methylbenzenesulfonamide IUPAC Name: N-[1-cyano-2-(dibenzylamino)-3-phenylpropyl]-4-methylbenzenesulfonamide Traditional Name: N-[1-cyano-2-(dibenzylamino)-3-phenyl-propyl]-4-methyl-benzenesulfonamide Formula: C31H31N3O2S MolecularWeight: 509.66174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C#N)C(CC2=CC=CC=C2)N(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C#N)C(CC2=CC=CC=C2)N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C31H31N3O2S/c1-25-17-19-29(20-18-25)37(35,36)33-30(22-32)31(21-26-11-5-2-6-12-26)34(23-27-13-7-3-8-14-27)24-28-15-9-4-10-16-28/h2-20,30-31,33H,21,23-24H2,1H3