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

Systemtic Name: (E)-2-(4-bromophenyl)sulfonyl-3-(4-oxidanylidene-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile Openeye Name: (E)-2-(4-bromophenyl)sulfonyl-3-(4-oxo-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile CAS Name: (E)-2-(4-bromophenyl)sulfonyl-3-(4-oxo-2-phenoxy-3-pyrido[1,2-a]pyrimidinyl)-2-propenenitrile IUPAC Name: (E)-2-(4-bromophenyl)sulfonyl-3-(4-oxo-2-phenoxypyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile Traditional Name: (E)-2-brosyl-3-(4-keto-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)acrylonitrile Formula: C23H14BrN3O4S MolecularWeight: 508.34396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C(=O)N3C=CC=CC3=N2)C=C(C#N)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C(=O)N3C=CC=CC3=N2)/C=C(\C#N)/S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H14BrN3O4S/c24-16-9-11-18(12-10-16)32(29,30)19(15-25)14-20-22(31-17-6-2-1-3-7-17)26-21-8-4-5-13-27(21)23(20)28/h1-14H/b19-14+