N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-methylsulfanyl-6-oxidanylidene-4-phenyl-pyrimidin-1-yl)ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-methylsulfanyl-6-oxidanylidene-4-phenyl-pyrimidin-1-yl)ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-methylsulfanyl-6-oxo-4-phenyl-pyrimidin-1-yl)acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2-(methylthio)-6-oxo-4-phenyl-1-pyrimidinyl]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-methylsulfanyl-6-oxo-4-phenylpyrimidin-1-yl)acetamide Traditional Name: N-homoveratryl-2-[6-keto-2-(methylthio)-4-phenyl-pyrimidin-1-yl]acetamide Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CN2C(=O)C=C(N=C2SC)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CN2C(=O)C=C(N=C2SC)C3=CC=CC=C3)OC

InChI

InChI=1S/C23H25N3O4S/c1-29-19-10-9-16(13-20(19)30-2)11-12-24-21(27)15-26-22(28)14-18(25-23(26)31-3)17-7-5-4-6-8-17/h4-10,13-14H,11-12,15H2,1-3H3,(H,24,27)