(3S)-N-[(Z)-(5-methylfuran-2-yl)methylideneamino]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-[(Z)-(5-methylfuran-2-yl)methylideneamino]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(benzenesulfonyl)-N-[(Z)-(5-methyl-2-furyl)methyleneamino]piperidine-3-carboxamide CAS Name: (3S)-1-(benzenesulfonyl)-N-[(Z)-(5-methyl-2-furanyl)methylideneamino]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(benzenesulfonyl)-N-[(Z)-(5-methylfuran-2-yl)methylideneamino]piperidine-3-carboxamide Traditional Name: (3S)-1-besyl-N-[(Z)-(5-methyl-2-furyl)methyleneamino]nipecotamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C=NNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(O1)/C=N\NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H21N3O4S/c1-14-9-10-16(25-14)12-19-20-18(22)15-6-5-11-21(13-15)26(23,24)17-7-3-2-4-8-17/h2-4,7-10,12,15H,5-6,11,13H2,1H3,(H,20,22)/b19-12-/t15-/m0/s1