2-[(4-azanylquinazolin-2-yl)methylsulfanyl]-5,6-dimethyl-3-propan-2-yl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(4-azanylquinazolin-2-yl)methylsulfanyl]-5,6-dimethyl-3-propan-2-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(4-aminoquinazolin-2-yl)methylsulfanyl]-3-isopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(4-amino-2-quinazolinyl)methylthio]-5,6-dimethyl-3-propan-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(4-aminoquinazolin-2-yl)methylsulfanyl]-5,6-dimethyl-3-propan-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-aminoquinazolin-2-yl)methylthio]-3-isopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C20H21N5OS2 MolecularWeight: 411.54364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N5OS2/c1-10(2)25-19(26)16-11(3)12(4)28-18(16)24-20(25)27-9-15-22-14-8-6-5-7-13(14)17(21)23-15/h5-8,10H,9H2,1-4H3,(H2,21,22,23)