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

Systemtic Name: 3,5,6-trimethyl-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3,5,6-trimethyl-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3,5,6-trimethyl-2-[(4-oxo-1H-quinazolin-2-yl)methylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3,5,6-trimethyl-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-keto-1H-quinazolin-2-yl)methylthio]-3,5,6-trimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C18H16N4O2S2 MolecularWeight: 384.47524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=NC(=O)C4=CC=CC=C4N3)C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=NC(=O)C4=CC=CC=C4N3)C)C

InChI

InChI=1S/C18H16N4O2S2/c1-9-10(2)26-16-14(9)17(24)22(3)18(21-16)25-8-13-19-12-7-5-4-6-11(12)15(23)20-13/h4-7H,8H2,1-3H3,(H,19,20,23)