5-[(1E)-buta-1,3-dienyl]-3-(4-chlorophenyl)-2-methylsulfanyl-6-phenyl-pyrimidin-4-one

Systemtic Name: 5-[(1E)-buta-1,3-dienyl]-3-(4-chlorophenyl)-2-methylsulfanyl-6-phenyl-pyrimidin-4-one Openeye Name: 5-[(1E)-buta-1,3-dienyl]-3-(4-chlorophenyl)-2-methylsulfanyl-6-phenyl-pyrimidin-4-one CAS Name: 5-[(1E)-buta-1,3-dienyl]-3-(4-chlorophenyl)-2-(methylthio)-6-phenyl-4-pyrimidinone IUPAC Name: 5-[(1E)-buta-1,3-dienyl]-3-(4-chlorophenyl)-2-methylsulfanyl-6-phenylpyrimidin-4-one Traditional Name: 5-[(1E)-buta-1,3-dienyl]-3-(4-chlorophenyl)-2-(methylthio)-6-phenyl-pyrimidin-4-one Formula: C21H17ClN2OS MolecularWeight: 380.89048

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=O)N1C2=CC=C(C=C2)Cl)C=CC=C)C3=CC=CC=C3

Isomeric SMILES

CSC1=NC(=C(C(=O)N1C2=CC=C(C=C2)Cl)/C=C/C=C)C3=CC=CC=C3

InChI

InChI=1S/C21H17ClN2OS/c1-3-4-10-18-19(15-8-6-5-7-9-15)23-21(26-2)24(20(18)25)17-13-11-16(22)12-14-17/h3-14H,1H2,2H3/b10-4+