(3S)-1-(4-methylphenyl)sulfonyl-N-(pentan-3-ylideneamino)piperidine-3-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(=NNC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C)CC

InChI

InChI=1S/C18H27N3O3S/c1-4-16(5-2)19-20-18(22)15-7-6-12-21(13-15)25(23,24)17-10-8-14(3)9-11-17/h8-11,15H,4-7,12-13H2,1-3H3,(H,20,22)/t15-/m0/s1