1,2,4-triazol-1-ylmethyl N-[(2,6-dimethylphenyl)amino]carbamodithioate

Systemtic Name: 1,2,4-triazol-1-ylmethyl N-[(2,6-dimethylphenyl)amino]carbamodithioate Openeye Name: 1,2,4-triazol-1-ylmethyl N-(2,6-dimethylanilino)carbamodithioate CAS Name: N-(2,6-dimethylanilino)carbamodithioic acid 1,2,4-triazol-1-ylmethyl ester IUPAC Name: 1,2,4-triazol-1-ylmethyl N-(2,6-dimethylanilino)carbamodithioate Traditional Name: N-(2,6-dimethylanilino)carbamodithioic acid 1,2,4-triazol-1-ylmethyl ester Formula: C12H15N5S2 MolecularWeight: 293.411

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NNC(=S)SCN2C=NC=N2

Isomeric SMILES

CC1=C(C(=CC=C1)C)NNC(=S)SCN2C=NC=N2

InChI

InChI=1S/C12H15N5S2/c1-9-4-3-5-10(2)11(9)15-16-12(18)19-8-17-7-13-6-14-17/h3-7,15H,8H2,1-2H3,(H,16,18)