2-[[5-cyano-6-(4-dimethylaminophenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N,N-diphenyl-ethanamide

Systemtic Name: 2-[[5-cyano-6-(4-dimethylaminophenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N,N-diphenyl-ethanamide Openeye Name: 2-[[5-cyano-6-(4-dimethylaminophenyl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]-N,N-diphenyl-acetamide CAS Name: 2-[[5-cyano-6-(4-dimethylaminophenyl)-4-oxo-1H-pyrimidin-2-yl]thio]-N,N-diphenylacetamide IUPAC Name: 2-[[5-cyano-6-(4-dimethylaminophenyl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]-N,N-diphenylacetamide Traditional Name: 2-[[5-cyano-6-(4-dimethylaminophenyl)-4-keto-1H-pyrimidin-2-yl]thio]-N,N-diphenyl-acetamide Formula: C27H23N5O2S MolecularWeight: 481.56882

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=C(C(=O)N=C(N2)SCC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=C(C(=O)N=C(N2)SCC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C27H23N5O2S/c1-31(2)20-15-13-19(14-16-20)25-23(17-28)26(34)30-27(29-25)35-18-24(33)32(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-16H,18H2,1-2H3,(H,29,30,34)