3-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(2-chloro-7-methylsulfanyl-3-quinolyl)methyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[[2-chloro-7-(methylthio)-3-quinolinyl]methyl]-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(2-chloro-7-methylsulfanylquinolin-3-yl)methyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[[2-chloro-7-(methylthio)-3-quinolyl]methyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C19H16ClN3OS2 MolecularWeight: 401.93284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC3=C(N=C4C=C(C=CC4=C3)SC)Cl)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC3=C(N=C4C=C(C=CC4=C3)SC)Cl)C

InChI

InChI=1S/C19H16ClN3OS2/c1-10-11(2)26-18-16(10)19(24)23(9-21-18)8-13-6-12-4-5-14(25-3)7-15(12)22-17(13)20/h4-7,9H,8H2,1-3H3