2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-methyl-6-propan-2-yl-pyrimidin-4-one

Systemtic Name: 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-methyl-6-propan-2-yl-pyrimidin-4-one Openeye Name: 2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-6-isopropyl-3-methyl-pyrimidin-4-one CAS Name: 2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-3-methyl-6-propan-2-yl-4-pyrimidinone IUPAC Name: 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-3-methyl-6-propan-2-ylpyrimidin-4-one Traditional Name: 2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-6-isopropyl-3-methyl-pyrimidin-4-one Formula: C16H17ClN2O2S MolecularWeight: 336.83638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)N(C(=N1)SCC(=O)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC(C)C1=CC(=O)N(C(=N1)SCC(=O)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C16H17ClN2O2S/c1-10(2)13-8-15(21)19(3)16(18-13)22-9-14(20)11-4-6-12(17)7-5-11/h4-8,10H,9H2,1-3H3