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

Systemtic Name: 3-(9-methyl-4-oxidanylidene-2-piperidin-1-yl-pyrido[1,2-a]pyrimidin-3-yl)-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: 2-(benzenesulfonyl)-3-[9-methyl-4-oxo-2-(1-piperidyl)pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile CAS Name: 2-(benzenesulfonyl)-3-[9-methyl-4-oxo-2-(1-piperidinyl)-3-pyrido[1,2-a]pyrimidinyl]-2-propenenitrile IUPAC Name: 2-(benzenesulfonyl)-3-(9-methyl-4-oxo-2-piperidin-1-ylpyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile Traditional Name: 2-besyl-3-(4-keto-9-methyl-2-piperidino-pyrido[1,2-a]pyrimidin-3-yl)acrylonitrile Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)S(=O)(=O)C3=CC=CC=C3)N4CCCCC4

Isomeric SMILES

CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)S(=O)(=O)C3=CC=CC=C3)N4CCCCC4

InChI

InChI=1S/C23H22N4O3S/c1-17-9-8-14-27-21(17)25-22(26-12-6-3-7-13-26)20(23(27)28)15-19(16-24)31(29,30)18-10-4-2-5-11-18/h2,4-5,8-11,14-15H,3,6-7,12-13H2,1H3