2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-3-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-3-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-3-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylthio]-3-methyl-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-3-methyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-amino-6-anilino-s-triazin-2-yl)methylthio]-3-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one Formula: C21H17N7OS3 MolecularWeight: 479.60098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC3=NC(=NC(=N3)NC4=CC=CC=C4)N)SC=C2C5=CC=CS5

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC3=NC(=NC(=N3)NC4=CC=CC=C4)N)SC=C2C5=CC=CS5

InChI

InChI=1S/C21H17N7OS3/c1-28-18(29)16-13(14-8-5-9-30-14)10-31-17(16)26-21(28)32-11-15-24-19(22)27-20(25-15)23-12-6-3-2-4-7-12/h2-10H,11H2,1H3,(H3,22,23,24,25,27)