3-(9-methyl-4-oxidanylidene-2-piperidin-1-yl-pyrido[1,2-a]pyrimidin-3-yl)-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: 3-(9-methyl-4-oxidanylidene-2-piperidin-1-yl-pyrido[1,2-a]pyrimidin-3-yl)-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-[9-methyl-4-oxo-2-(1-piperidyl)pyrido[1,2-a]pyrimidin-3-yl]-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: 3-[9-methyl-4-oxo-2-(1-piperidinyl)-3-pyrido[1,2-a]pyrimidinyl]-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-(9-methyl-4-oxo-2-piperidin-1-ylpyrido[1,2-a]pyrimidin-3-yl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: 3-(4-keto-9-methyl-2-piperidino-pyrido[1,2-a]pyrimidin-3-yl)-2-tosyl-acrylonitrile Formula: C24H24N4O3S MolecularWeight: 448.53736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)N4CCCCC4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)N4CCCCC4)C#N

InChI

InChI=1S/C24H24N4O3S/c1-17-8-10-19(11-9-17)32(30,31)20(16-25)15-21-23(27-12-4-3-5-13-27)26-22-18(2)7-6-14-28(22)24(21)29/h6-11,14-15H,3-5,12-13H2,1-2H3