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

Systemtic Name: 3-[2-(4-methoxyphenoxy)-9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: 2-(benzenesulfonyl)-3-[2-(4-methoxyphenoxy)-9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile CAS Name: 2-(benzenesulfonyl)-3-[2-(4-methoxyphenoxy)-9-methyl-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-propenenitrile IUPAC Name: 2-(benzenesulfonyl)-3-[2-(4-methoxyphenoxy)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile Traditional Name: 2-besyl-3-[4-keto-2-(4-methoxyphenoxy)-9-methyl-pyrido[1,2-a]pyrimidin-3-yl]acrylonitrile Formula: C25H19N3O5S MolecularWeight: 473.50046

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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=C(C=C4)OC

Isomeric SMILES

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

InChI

InChI=1S/C25H19N3O5S/c1-17-7-6-14-28-23(17)27-24(33-19-12-10-18(32-2)11-13-19)22(25(28)29)15-21(16-26)34(30,31)20-8-4-3-5-9-20/h3-15H,1-2H3