N-(2-chlorophenyl)-2-[4-(6,6-dimethyl-3-methylsulfanyl-4-oxidanylidene-5,7-dihydro-2-benzothiophen-1-yl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-chlorophenyl)-2-[4-(6,6-dimethyl-3-methylsulfanyl-4-oxidanylidene-5,7-dihydro-2-benzothiophen-1-yl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-chlorophenyl)-2-[4-(6,6-dimethyl-3-methylsulfanyl-4-oxo-5,7-dihydro-2-benzothiophen-1-yl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(2-chlorophenyl)-2-[[4-[6,6-dimethyl-3-(methylthio)-4-oxo-5,7-dihydro-2-benzothiophen-1-yl]-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(2-chlorophenyl)-2-[4-(6,6-dimethyl-3-methylsulfanyl-4-oxo-5,7-dihydro-2-benzothiophen-1-yl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(2-chlorophenyl)-2-[[4-[4-keto-6,6-dimethyl-3-(methylthio)-5,7-dihydroisobenzothiophen-1-yl]pyrimidin-2-yl]thio]acetamide Formula: C23H22ClN3O2S3 MolecularWeight: 504.08768

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(SC(=C2C(=O)C1)SC)C3=NC(=NC=C3)SCC(=O)NC4=CC=CC=C4Cl)C

Isomeric SMILES

CC1(CC2=C(SC(=C2C(=O)C1)SC)C3=NC(=NC=C3)SCC(=O)NC4=CC=CC=C4Cl)C

InChI

InChI=1S/C23H22ClN3O2S3/c1-23(2)10-13-19(17(28)11-23)21(30-3)32-20(13)16-8-9-25-22(27-16)31-12-18(29)26-15-7-5-4-6-14(15)24/h4-9H,10-12H2,1-3H3,(H,26,29)