(3S)-1-(phenylsulfonyl)-N-[(Z)-1-pyridin-2-ylethylideneamino]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(phenylsulfonyl)-N-[(Z)-1-pyridin-2-ylethylideneamino]piperidine-3-carboxamide Openeye Name: (3S)-1-(benzenesulfonyl)-N-[(Z)-1-(2-pyridyl)ethylideneamino]piperidine-3-carboxamide CAS Name: (3S)-1-(benzenesulfonyl)-N-[(Z)-1-(2-pyridinyl)ethylideneamino]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(benzenesulfonyl)-N-[(Z)-1-pyridin-2-ylethylideneamino]piperidine-3-carboxamide Traditional Name: (3S)-1-besyl-N-[(Z)-1-(2-pyridyl)ethylideneamino]nipecotamide Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=N3

Isomeric SMILES

C/C(=N/NC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC=CC=C2)/C3=CC=CC=N3

InChI

InChI=1S/C19H22N4O3S/c1-15(18-11-5-6-12-20-18)21-22-19(24)16-8-7-13-23(14-16)27(25,26)17-9-3-2-4-10-17/h2-6,9-12,16H,7-8,13-14H2,1H3,(H,22,24)/b21-15-/t16-/m0/s1