N-(3-chloranyl-4-methoxy-phenyl)-2-[[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-[[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]sulfanyl]ethanamide Openeye Name: 2-[(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(3-chloro-4-methoxy-phenyl)acetamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-[[6-methyl-4-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]thio]acetamide IUPAC Name: 2-[(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(3-chloro-4-methoxyphenyl)acetamide Traditional Name: 2-[(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)thio]-N-(3-chloro-4-methoxy-phenyl)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)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC(=O)NC2=CC(=C(C=C2)OC)Cl)CC3=CC=CC=C3

InChI

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