(3S)-N-[(Z)-(4-ethylphenyl)methylideneamino]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-[(Z)-(4-ethylphenyl)methylideneamino]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-[(Z)-(4-ethylphenyl)methyleneamino]-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-N-[(Z)-(4-ethylphenyl)methylideneamino]-1-(4-methylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-[(Z)-(4-ethylphenyl)methylideneamino]-1-(4-methylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-[(Z)-(4-ethylbenzylidene)amino]-1-tosyl-nipecotamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=NNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)/C=N\NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H27N3O3S/c1-3-18-8-10-19(11-9-18)15-23-24-22(26)20-5-4-14-25(16-20)29(27,28)21-12-6-17(2)7-13-21/h6-13,15,20H,3-5,14,16H2,1-2H3,(H,24,26)/b23-15-/t20-/m0/s1