2-[3-(4-chloranyl-3-methyl-phenyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanyl-N-phenethyl-ethanamide

Systemtic Name: 2-[3-(4-chloranyl-3-methyl-phenyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-[3-(4-chloro-3-methyl-phenyl)-4-oxo-thieno[3,2-d]pyrimidin-2-yl]sulfanyl-N-phenethyl-acetamide CAS Name: 2-[[3-(4-chloro-3-methylphenyl)-4-oxo-2-thieno[3,2-d]pyrimidinyl]thio]-N-phenethylacetamide IUPAC Name: 2-[3-(4-chloro-3-methylphenyl)-4-oxothieno[3,2-d]pyrimidin-2-yl]sulfanyl-N-phenethylacetamide Traditional Name: 2-[[3-(4-chloro-3-methyl-phenyl)-4-keto-thieno[3,2-d]pyrimidin-2-yl]thio]-N-phenethyl-acetamide Formula: C23H20ClN3O2S2 MolecularWeight: 470.0068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2C(=O)C3=C(C=CS3)N=C2SCC(=O)NCCC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)N2C(=O)C3=C(C=CS3)N=C2SCC(=O)NCCC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H20ClN3O2S2/c1-15-13-17(7-8-18(15)24)27-22(29)21-19(10-12-30-21)26-23(27)31-14-20(28)25-11-9-16-5-3-2-4-6-16/h2-8,10,12-13H,9,11,14H2,1H3,(H,25,28)