2-[[5-[(2-chlorophenyl)methyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-[[5-[(2-chlorophenyl)methyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[[5-[(2-chlorophenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(4-methoxyphenyl)acetamide CAS Name: 2-[[5-[(2-chlorophenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[[5-[(2-chlorophenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[[5-(2-chlorobenzyl)-4-keto-6-methyl-1H-pyrimidin-2-yl]thio]-N-(4-methoxyphenyl)acetamide Formula: C21H20ClN3O3S MolecularWeight: 429.9198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC(=O)NC2=CC=C(C=C2)OC)CC3=CC=CC=C3Cl

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC(=O)NC2=CC=C(C=C2)OC)CC3=CC=CC=C3Cl

InChI

InChI=1S/C21H20ClN3O3S/c1-13-17(11-14-5-3-4-6-18(14)22)20(27)25-21(23-13)29-12-19(26)24-15-7-9-16(28-2)10-8-15/h3-10H,11-12H2,1-2H3,(H,24,26)(H,23,25,27)