3-(3,4-dichlorophenyl)-5,6-dimethyl-2-phenacylsulfanyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(3,4-dichlorophenyl)-5,6-dimethyl-2-phenacylsulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(3,4-dichlorophenyl)-5,6-dimethyl-2-phenacylsulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(3,4-dichlorophenyl)-5,6-dimethyl-2-(phenacylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(3,4-dichlorophenyl)-5,6-dimethyl-2-phenacylsulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(3,4-dichlorophenyl)-5,6-dimethyl-2-(phenacylthio)thieno[2,3-d]pyrimidin-4-one Formula: C22H16Cl2N2O2S2 MolecularWeight: 475.41064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl)C

InChI

InChI=1S/C22H16Cl2N2O2S2/c1-12-13(2)30-20-19(12)21(28)26(15-8-9-16(23)17(24)10-15)22(25-20)29-11-18(27)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3