N-(5-chloranyl-2-methoxy-phenyl)-2-(6-methyl-2-phenacylsulfanyl-pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-(6-methyl-2-phenacylsulfanyl-pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2-(6-methyl-2-phenacylsulfanyl-pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2-[[6-methyl-2-(phenacylthio)-4-pyrimidinyl]thio]acetamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-(6-methyl-2-phenacylsulfanylpyrimidin-4-yl)sulfanylacetamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-[[6-methyl-2-(phenacylthio)pyrimidin-4-yl]thio]acetamide Formula: C22H20ClN3O3S2 MolecularWeight: 473.9955

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)C2=CC=CC=C2)SCC(=O)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)C2=CC=CC=C2)SCC(=O)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C22H20ClN3O3S2/c1-14-10-21(26-22(24-14)31-12-18(27)15-6-4-3-5-7-15)30-13-20(28)25-17-11-16(23)8-9-19(17)29-2/h3-11H,12-13H2,1-2H3,(H,25,28)