(E)-2-(4-methylphenyl)sulfonyl-3-(4-oxidanylidene-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-methylphenyl)sulfonyl-3-(4-oxidanylidene-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile Openeye Name: (E)-3-(4-oxo-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: (E)-2-(4-methylphenyl)sulfonyl-3-(4-oxo-2-phenoxy-3-pyrido[1,2-a]pyrimidinyl)-2-propenenitrile IUPAC Name: (E)-2-(4-methylphenyl)sulfonyl-3-(4-oxo-2-phenoxypyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile Traditional Name: (E)-3-(4-keto-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)-2-tosyl-acrylonitrile Formula: C24H17N3O4S MolecularWeight: 443.47448

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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)OC4=CC=CC=C4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/C2=C(N=C3C=CC=CN3C2=O)OC4=CC=CC=C4)/C#N

InChI

InChI=1S/C24H17N3O4S/c1-17-10-12-19(13-11-17)32(29,30)20(16-25)15-21-23(31-18-7-3-2-4-8-18)26-22-9-5-6-14-27(22)24(21)28/h2-15H,1H3/b20-15+