propan-2-yl 4-[[2-[(2-chlorophenyl)methylsulfanyl]-4-methyl-6-oxidanylidene-pyrimidin-1-yl]methyl]benzoate

Systemtic Name: propan-2-yl 4-[[2-[(2-chlorophenyl)methylsulfanyl]-4-methyl-6-oxidanylidene-pyrimidin-1-yl]methyl]benzoate Openeye Name: isopropyl 4-[[2-[(2-chlorophenyl)methylsulfanyl]-4-methyl-6-oxo-pyrimidin-1-yl]methyl]benzoate CAS Name: 4-[[2-[(2-chlorophenyl)methylthio]-4-methyl-6-oxo-1-pyrimidinyl]methyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-[(2-chlorophenyl)methylsulfanyl]-4-methyl-6-oxopyrimidin-1-yl]methyl]benzoate Traditional Name: 4-[[2-[(2-chlorobenzyl)thio]-6-keto-4-methyl-pyrimidin-1-yl]methyl]benzoic acid isopropyl ester Formula: C23H23ClN2O3S MolecularWeight: 442.95832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCC2=CC=CC=C2Cl)CC3=CC=C(C=C3)C(=O)OC(C)C

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCC2=CC=CC=C2Cl)CC3=CC=C(C=C3)C(=O)OC(C)C

InChI

InChI=1S/C23H23ClN2O3S/c1-15(2)29-22(28)18-10-8-17(9-11-18)13-26-21(27)12-16(3)25-23(26)30-14-19-6-4-5-7-20(19)24/h4-12,15H,13-14H2,1-3H3