4-(2-methylpropyl)-3-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(2-methylpropyl)-3-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-isobutyl-3-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 4-(2-methylpropyl)-3-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2-methylpropyl)-3-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-isobutyl-3-phenyl-1H-1,2,4-triazole-5-thione Formula: C12H15N3S MolecularWeight: 233.3326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NNC1=S)C2=CC=CC=C2

Isomeric SMILES

CC(C)CN1C(=NNC1=S)C2=CC=CC=C2

InChI

InChI=1S/C12H15N3S/c1-9(2)8-15-11(13-14-12(15)16)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,14,16)