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

Systemtic Name: 3-(9-methyl-4-oxidanylidene-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: 2-(benzenesulfonyl)-3-(9-methyl-4-oxo-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile CAS Name: 2-(benzenesulfonyl)-3-(9-methyl-4-oxo-2-phenoxy-3-pyrido[1,2-a]pyrimidinyl)-2-propenenitrile IUPAC Name: 2-(benzenesulfonyl)-3-(9-methyl-4-oxo-2-phenoxypyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile Traditional Name: 2-besyl-3-(4-keto-9-methyl-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)acrylonitrile Formula: C24H17N3O4S MolecularWeight: 443.47448

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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)OC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)S(=O)(=O)C3=CC=CC=C3)OC4=CC=CC=C4

InChI

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