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

Systemtic Name: 2-[(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[(6-chloro-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(6-chloro-4-oxo-1H-quinazolin-2-yl)methylthio]-5-phenyl-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(6-chloro-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-5-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[(6-chloro-4-keto-1H-quinazolin-2-yl)methylthio]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C24H17ClN4O2S2 MolecularWeight: 493.00038

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1SCC3=NC(=O)C4=C(N3)C=CC(=C4)Cl)SC=C2C5=CC=CC=C5

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1SCC3=NC(=O)C4=C(N3)C=CC(=C4)Cl)SC=C2C5=CC=CC=C5

InChI

InChI=1S/C24H17ClN4O2S2/c1-2-10-29-23(31)20-17(14-6-4-3-5-7-14)12-32-22(20)28-24(29)33-13-19-26-18-9-8-15(25)11-16(18)21(30)27-19/h2-9,11-12H,1,10,13H2,(H,26,27,30)