5-[(3,4-dimethylphenyl)methyl]-1,2-dihydro-1,2,4-triazole-3-thione

Systemtic Name: 5-[(3,4-dimethylphenyl)methyl]-1,2-dihydro-1,2,4-triazole-3-thione Openeye Name: 5-[(3,4-dimethylphenyl)methyl]-1,2-dihydro-1,2,4-triazole-3-thione CAS Name: 5-[(3,4-dimethylphenyl)methyl]-1,2-dihydro-1,2,4-triazole-3-thione IUPAC Name: 5-[(3,4-dimethylphenyl)methyl]-1,2-dihydro-1,2,4-triazole-3-thione Traditional Name: 5-(3,4-dimethylbenzyl)-1,2-dihydro-1,2,4-triazole-3-thione Formula: C11H13N3S MolecularWeight: 219.30602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2=NC(=S)NN2)C

Isomeric SMILES

CC1=C(C=C(C=C1)CC2=NC(=S)NN2)C

InChI

InChI=1S/C11H13N3S/c1-7-3-4-9(5-8(7)2)6-10-12-11(15)14-13-10/h3-5H,6H2,1-2H3,(H2,12,13,14,15)