1,3-dimethyl-5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pyrazol-4-amine

Systemtic Name: 1,3-dimethyl-5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pyrazol-4-amine Openeye Name: 1,3-dimethyl-5-(1-phenyltetrazol-5-yl)sulfanyl-pyrazol-4-amine CAS Name: 1,3-dimethyl-5-[(1-phenyl-5-tetrazolyl)thio]-4-pyrazolamine IUPAC Name: 1,3-dimethyl-5-(1-phenyltetrazol-5-yl)sulfanylpyrazol-4-amine Traditional Name: [1,3-dimethyl-5-[(1-phenyltetrazol-5-yl)thio]pyrazol-4-yl]amine Formula: C12H13N7S MolecularWeight: 287.34352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1N)SC2=NN=NN2C3=CC=CC=C3)C

Isomeric SMILES

CC1=NN(C(=C1N)SC2=NN=NN2C3=CC=CC=C3)C

InChI

InChI=1S/C12H13N7S/c1-8-10(13)11(18(2)15-8)20-12-14-16-17-19(12)9-6-4-3-5-7-9/h3-7H,13H2,1-2H3