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

Systemtic Name: 3-butyl-5,6-dimethyl-2-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-butyl-5,6-dimethyl-2-[1-(4-oxo-1H-quinazolin-2-yl)ethylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-butyl-5,6-dimethyl-2-[1-(4-oxo-1H-quinazolin-2-yl)ethylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-butyl-5,6-dimethyl-2-[1-(4-oxo-1H-quinazolin-2-yl)ethylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-butyl-2-[1-(4-keto-1H-quinazolin-2-yl)ethylthio]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H24N4O2S2 MolecularWeight: 440.58156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(N=C1SC(C)C3=NC(=O)C4=CC=CC=C4N3)SC(=C2C)C

Isomeric SMILES

CCCCN1C(=O)C2=C(N=C1SC(C)C3=NC(=O)C4=CC=CC=C4N3)SC(=C2C)C

InChI

InChI=1S/C22H24N4O2S2/c1-5-6-11-26-21(28)17-12(2)13(3)29-20(17)25-22(26)30-14(4)18-23-16-10-8-7-9-15(16)19(27)24-18/h7-10,14H,5-6,11H2,1-4H3,(H,23,24,27)