(E)-3-(7-methyl-4-oxidanylidene-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)-2-(phenylsulfonyl)prop-2-enenitrile

Systemtic Name: (E)-3-(7-methyl-4-oxidanylidene-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: (E)-2-(benzenesulfonyl)-3-(7-methyl-4-oxo-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile CAS Name: (E)-2-(benzenesulfonyl)-3-(7-methyl-4-oxo-2-phenoxy-3-pyrido[1,2-a]pyrimidinyl)-2-propenenitrile IUPAC Name: (E)-2-(benzenesulfonyl)-3-(7-methyl-4-oxo-2-phenoxypyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile Traditional Name: (E)-2-besyl-3-(4-keto-7-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=CN2C(=NC(=C(C2=O)C=C(C#N)S(=O)(=O)C3=CC=CC=C3)OC4=CC=CC=C4)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=C(C2=O)/C=C(\C#N)/S(=O)(=O)C3=CC=CC=C3)OC4=CC=CC=C4)C=C1

InChI

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