N-(1,3-benzodioxol-5-ylmethyl)-2-[(3-cyano-4-methyl-6-oxidanylidene-1H-pyridin-2-yl)sulfanyl]-N-phenyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3-cyano-4-methyl-6-oxidanylidene-1H-pyridin-2-yl)sulfanyl]-N-phenyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanyl]-N-phenyl-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)thio]-N-phenylacetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanyl]-N-phenylacetamide Traditional Name: 2-[(3-cyano-6-keto-4-methyl-1H-pyridin-2-yl)thio]-N-phenyl-N-piperonyl-acetamide Formula: C23H19N3O4S MolecularWeight: 433.47966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)NC(=C1C#N)SCC(=O)N(CC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)NC(=C1C#N)SCC(=O)N(CC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

InChI

InChI=1S/C23H19N3O4S/c1-15-9-21(27)25-23(18(15)11-24)31-13-22(28)26(17-5-3-2-4-6-17)12-16-7-8-19-20(10-16)30-14-29-19/h2-10H,12-14H2,1H3,(H,25,27)