1-(4-methylphenyl)sulfonyl-N-[(E)-pyridin-3-ylmethylideneamino]piperidine-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-[(E)-pyridin-3-ylmethylideneamino]piperidine-4-carboxamide Openeye Name: 1-(p-tolylsulfonyl)-N-[(E)-3-pyridylmethyleneamino]piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-[(E)-3-pyridinylmethylideneamino]-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-[(E)-pyridin-3-ylmethylideneamino]piperidine-4-carboxamide Traditional Name: N-[(E)-3-pyridylmethyleneamino]-1-tosyl-isonipecotamide Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NN=CC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N/N=C/C3=CN=CC=C3

InChI

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