4-[2-(cyclopropylmethylamino)-2-oxidanylidene-ethyl]-5-(4-methylphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[2-(cyclopropylmethylamino)-2-oxidanylidene-ethyl]-5-(4-methylphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-[2-(cyclopropylmethylamino)-2-oxo-ethyl]-5-(p-tolyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[2-(cyclopropylmethylamino)-2-oxoethyl]-5-(4-methylphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-[2-(cyclopropylmethylamino)-2-oxoethyl]-5-(4-methylphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-[2-(cyclopropylmethylamino)-2-keto-ethyl]-5-(p-tolyl)-1,2,4-triazole-3-thiolate Formula: C15H17N4OS- MolecularWeight: 301.38668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2CC(=O)NCC3CC3)[S-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2CC(=O)NCC3CC3)[S-]

InChI

InChI=1S/C15H18N4OS/c1-10-2-6-12(7-3-10)14-17-18-15(21)19(14)9-13(20)16-8-11-4-5-11/h2-3,6-7,11H,4-5,8-9H2,1H3,(H,16,20)(H,18,21)/p-1