2-[[4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl]-5-thiophen-2-yl-1,2,3,4-tetrazole

Systemtic Name: 2-[[4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl]-5-thiophen-2-yl-1,2,3,4-tetrazole Openeye Name: 2-[[4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl]-5-(2-thienyl)tetrazole CAS Name: 2-[[4-(3,5-dimethyl-1-pyrazolyl)phenyl]methyl]-5-thiophen-2-yltetrazole IUPAC Name: 2-[[4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl]-5-thiophen-2-yltetrazole Traditional Name: 2-[4-(3,5-dimethylpyrazol-1-yl)benzyl]-5-(2-thienyl)tetrazole Formula: C17H16N6S MolecularWeight: 336.41414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)CN3N=C(N=N3)C4=CC=CS4)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)CN3N=C(N=N3)C4=CC=CS4)C

InChI

InChI=1S/C17H16N6S/c1-12-10-13(2)23(19-12)15-7-5-14(6-8-15)11-22-20-17(18-21-22)16-4-3-9-24-16/h3-10H,11H2,1-2H3