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

Systemtic Name: (E)-2-(4-bromophenyl)sulfonyl-3-(7-methyl-4-oxidanylidene-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile Openeye Name: (E)-2-(4-bromophenyl)sulfonyl-3-(7-methyl-4-oxo-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile CAS Name: (E)-2-(4-bromophenyl)sulfonyl-3-(7-methyl-4-oxo-2-phenoxy-3-pyrido[1,2-a]pyrimidinyl)-2-propenenitrile IUPAC Name: (E)-2-(4-bromophenyl)sulfonyl-3-(7-methyl-4-oxo-2-phenoxypyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile Traditional Name: (E)-2-brosyl-3-(4-keto-7-methyl-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)acrylonitrile Formula: C24H16BrN3O4S MolecularWeight: 522.37054

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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=C(C=C3)Br)OC4=CC=CC=C4)C=C1

Isomeric SMILES

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

InChI

InChI=1S/C24H16BrN3O4S/c1-16-7-12-22-27-23(32-18-5-3-2-4-6-18)21(24(29)28(22)15-16)13-20(14-26)33(30,31)19-10-8-17(25)9-11-19/h2-13,15H,1H3/b20-13+