3-(4-chloranyl-3-methyl-phenyl)-2-[(2-methylphenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-(4-chloranyl-3-methyl-phenyl)-2-[(2-methylphenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-(4-chloro-3-methyl-phenyl)-2-(o-tolylmethylsulfanyl)thieno[3,2-d]pyrimidin-4-one CAS Name: 3-(4-chloro-3-methylphenyl)-2-[(2-methylphenyl)methylthio]-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-(4-chloro-3-methylphenyl)-2-[(2-methylphenyl)methylsulfanyl]thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-(4-chloro-3-methyl-phenyl)-2-[(2-methylbenzyl)thio]thieno[3,2-d]pyrimidin-4-one Formula: C21H17ClN2OS2 MolecularWeight: 412.95548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC3=C(C(=O)N2C4=CC(=C(C=C4)Cl)C)SC=C3

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC3=C(C(=O)N2C4=CC(=C(C=C4)Cl)C)SC=C3

InChI

InChI=1S/C21H17ClN2OS2/c1-13-5-3-4-6-15(13)12-27-21-23-18-9-10-26-19(18)20(25)24(21)16-7-8-17(22)14(2)11-16/h3-11H,12H2,1-2H3