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

Systemtic Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(4-oxidanylidene-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile Openeye Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(4-oxo-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile CAS Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(4-oxo-2-phenoxy-3-pyrido[1,2-a]pyrimidinyl)-2-propenenitrile IUPAC Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(4-oxo-2-phenoxypyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile Traditional Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(4-keto-2-phenoxy-pyrido[1,2-a]pyrimidin-3-yl)acrylonitrile Formula: C24H14N4O2S MolecularWeight: 422.45856

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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)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C(=O)N3C=CC=CC3=N2)/C=C(\C#N)/C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H14N4O2S/c25-15-16(23-26-19-10-4-5-11-20(19)31-23)14-18-22(30-17-8-2-1-3-9-17)27-21-12-6-7-13-28(21)24(18)29/h1-14H/b16-14+