2-[(4-azanylquinazolin-2-yl)methylsulfanyl]-5-(3,4-dimethylphenyl)-3-methyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(4-azanylquinazolin-2-yl)methylsulfanyl]-5-(3,4-dimethylphenyl)-3-methyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(4-aminoquinazolin-2-yl)methylsulfanyl]-5-(3,4-dimethylphenyl)-3-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(4-amino-2-quinazolinyl)methylthio]-5-(3,4-dimethylphenyl)-3-methyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(4-aminoquinazolin-2-yl)methylsulfanyl]-5-(3,4-dimethylphenyl)-3-methylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-aminoquinazolin-2-yl)methylthio]-5-(3,4-dimethylphenyl)-3-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C24H21N5OS2 MolecularWeight: 459.58644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC4=NC5=CC=CC=C5C(=N4)N)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC4=NC5=CC=CC=C5C(=N4)N)C)C

InChI

InChI=1S/C24H21N5OS2/c1-13-8-9-15(10-14(13)2)17-11-31-22-20(17)23(30)29(3)24(28-22)32-12-19-26-18-7-5-4-6-16(18)21(25)27-19/h4-11H,12H2,1-3H3,(H2,25,26,27)