2-[(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-3-cyclopentyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-3-cyclopentyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(6-chloro-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-3-cyclopentyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(6-chloro-4-oxo-1H-quinazolin-2-yl)methylthio]-3-cyclopentyl-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(6-chloro-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-3-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(6-chloro-4-keto-1H-quinazolin-2-yl)methylthio]-3-cyclopentyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H21ClN4O2S2 MolecularWeight: 473.01074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=NC(=O)C4=C(N3)C=CC(=C4)Cl)C5CCCC5)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=NC(=O)C4=C(N3)C=CC(=C4)Cl)C5CCCC5)C

InChI

InChI=1S/C22H21ClN4O2S2/c1-11-12(2)31-20-18(11)21(29)27(14-5-3-4-6-14)22(26-20)30-10-17-24-16-8-7-13(23)9-15(16)19(28)25-17/h7-9,14H,3-6,10H2,1-2H3,(H,24,25,28)