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

Systemtic Name: N-(4-ethanoylphenyl)-2-[6-oxidanylidene-4-phenyl-2-(phenylmethylsulfanyl)pyrimidin-1-yl]ethanamide Openeye Name: N-(4-acetylphenyl)-2-(2-benzylsulfanyl-6-oxo-4-phenyl-pyrimidin-1-yl)acetamide CAS Name: N-(4-acetylphenyl)-2-[6-oxo-4-phenyl-2-(phenylmethylthio)-1-pyrimidinyl]acetamide IUPAC Name: N-(4-acetylphenyl)-2-(2-benzylsulfanyl-6-oxo-4-phenylpyrimidin-1-yl)acetamide Traditional Name: N-(4-acetylphenyl)-2-[2-(benzylthio)-6-keto-4-phenyl-pyrimidin-1-yl]acetamide Formula: C27H23N3O3S MolecularWeight: 469.55482

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C=C(N=C2SCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C=C(N=C2SCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H23N3O3S/c1-19(31)21-12-14-23(15-13-21)28-25(32)17-30-26(33)16-24(22-10-6-3-7-11-22)29-27(30)34-18-20-8-4-2-5-9-20/h2-16H,17-18H2,1H3,(H,28,32)