6-phenyl-2-[(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-phenyl-2-[(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-phenyl-2-[[5-(3-thienyl)tetrazol-2-yl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-phenyl-2-[[5-(3-thiophenyl)-2-tetrazolyl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-phenyl-2-[(5-thiophen-3-yltetrazol-2-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-phenyl-2-[[5-(3-thienyl)tetrazol-2-yl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H12N6OS2 MolecularWeight: 392.45748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(S2)N=C(NC3=O)CN4N=C(N=N4)C5=CSC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)N=C(NC3=O)CN4N=C(N=N4)C5=CSC=C5

InChI

InChI=1S/C18H12N6OS2/c25-17-13-8-14(11-4-2-1-3-5-11)27-18(13)20-15(19-17)9-24-22-16(21-23-24)12-6-7-26-10-12/h1-8,10H,9H2,(H,19,20,25)