2-[[4-azanyl-5-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[4-azanyl-5-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[[4-amino-5-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[[4-amino-5-(4-chlorophenyl)-1,2,4-triazol-3-yl]thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[[4-amino-5-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[[4-amino-5-(4-chlorophenyl)-1,2,4-triazol-3-yl]thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C15H11ClN6OS2 MolecularWeight: 390.87044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN=C(N2N)SCC3=NC(=O)C4=C(N3)C=CS4)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NN=C(N2N)SCC3=NC(=O)C4=C(N3)C=CS4)Cl

InChI

InChI=1S/C15H11ClN6OS2/c16-9-3-1-8(2-4-9)13-20-21-15(22(13)17)25-7-11-18-10-5-6-24-12(10)14(23)19-11/h1-6H,7,17H2,(H,18,19,23)