2-[(4-azanylquinazolin-2-yl)methylsulfanyl]-6-methyl-5-(2-methylbutyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(4-azanylquinazolin-2-yl)methylsulfanyl]-6-methyl-5-(2-methylbutyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(4-aminoquinazolin-2-yl)methylsulfanyl]-6-methyl-5-(2-methylbutyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(4-amino-2-quinazolinyl)methylthio]-6-methyl-5-(2-methylbutyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(4-aminoquinazolin-2-yl)methylsulfanyl]-6-methyl-5-(2-methylbutyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-aminoquinazolin-2-yl)methylthio]-6-methyl-5-(2-methylbutyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H23N5OS2 MolecularWeight: 425.57022

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1=C(SC2=C1C(=O)NC(=N2)SCC3=NC4=CC=CC=C4C(=N3)N)C

Isomeric SMILES

CCC(C)CC1=C(SC2=C1C(=O)NC(=N2)SCC3=NC4=CC=CC=C4C(=N3)N)C

InChI

InChI=1S/C21H23N5OS2/c1-4-11(2)9-14-12(3)29-20-17(14)19(27)25-21(26-20)28-10-16-23-15-8-6-5-7-13(15)18(22)24-16/h5-8,11H,4,9-10H2,1-3H3,(H2,22,23,24)(H,25,26,27)