N-(3-ethanoylphenyl)-2-[4-methyl-6-oxidanylidene-2-(phenylmethylsulfanyl)pyrimidin-1-yl]ethanamide

Systemtic Name: N-(3-ethanoylphenyl)-2-[4-methyl-6-oxidanylidene-2-(phenylmethylsulfanyl)pyrimidin-1-yl]ethanamide Openeye Name: N-(3-acetylphenyl)-2-(2-benzylsulfanyl-4-methyl-6-oxo-pyrimidin-1-yl)acetamide CAS Name: N-(3-acetylphenyl)-2-[4-methyl-6-oxo-2-(phenylmethylthio)-1-pyrimidinyl]acetamide IUPAC Name: N-(3-acetylphenyl)-2-(2-benzylsulfanyl-4-methyl-6-oxopyrimidin-1-yl)acetamide Traditional Name: N-(3-acetylphenyl)-2-[2-(benzylthio)-6-keto-4-methyl-pyrimidin-1-yl]acetamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCC2=CC=CC=C2)CC(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCC2=CC=CC=C2)CC(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C22H21N3O3S/c1-15-11-21(28)25(22(23-15)29-14-17-7-4-3-5-8-17)13-20(27)24-19-10-6-9-18(12-19)16(2)26/h3-12H,13-14H2,1-2H3,(H,24,27)