(3S)-1-(2-methylphenyl)sulfonyl-N-[(Z)-(phenylmethylidene)amino]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(2-methylphenyl)sulfonyl-N-[(Z)-(phenylmethylidene)amino]piperidine-3-carboxamide Openeye Name: (3S)-N-[(Z)-benzylideneamino]-1-(o-tolylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-1-(2-methylphenyl)sulfonyl-N-[(Z)-(phenylmethylene)amino]-3-piperidinecarboxamide IUPAC Name: (3S)-N-[(Z)-benzylideneamino]-1-(2-methylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-[(Z)-benzalamino]-1-(o-tolylsulfonyl)nipecotamide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)N2CCCC(C2)C(=O)NN=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)N2CCC[C@@H](C2)C(=O)N/N=C\C3=CC=CC=C3

InChI

InChI=1S/C20H23N3O3S/c1-16-8-5-6-12-19(16)27(25,26)23-13-7-11-18(15-23)20(24)22-21-14-17-9-3-2-4-10-17/h2-6,8-10,12,14,18H,7,11,13,15H2,1H3,(H,22,24)/b21-14-/t18-/m0/s1