(3S)-1-(4-methylphenyl)sulfonyl-N-[(Z)-pentan-2-ylideneamino]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-methylphenyl)sulfonyl-N-[(Z)-pentan-2-ylideneamino]piperidine-3-carboxamide Openeye Name: (3S)-N-[(Z)-1-methylbutylideneamino]-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-1-(4-methylphenyl)sulfonyl-N-[(Z)-pentan-2-ylideneamino]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-methylphenyl)sulfonyl-N-[(Z)-pentan-2-ylideneamino]piperidine-3-carboxamide Traditional Name: (3S)-N-[(Z)-1-methylbutylideneamino]-1-tosyl-nipecotamide Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C)C

Isomeric SMILES

CCC/C(=N\NC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C)/C

InChI

InChI=1S/C18H27N3O3S/c1-4-6-15(3)19-20-18(22)16-7-5-12-21(13-16)25(23,24)17-10-8-14(2)9-11-17/h8-11,16H,4-7,12-13H2,1-3H3,(H,20,22)/b19-15-/t16-/m0/s1