3-methyl-4-(3-phenylprop-2-ynylamino)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-methyl-4-(3-phenylprop-2-ynylamino)-1H-1,2,4-triazole-5-thione Openeye Name: 3-methyl-4-(3-phenylprop-2-ynylamino)-1H-1,2,4-triazole-5-thione CAS Name: 3-methyl-4-(3-phenylprop-2-ynylamino)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-methyl-4-(3-phenylprop-2-ynylamino)-1H-1,2,4-triazole-5-thione Traditional Name: 3-methyl-4-(3-phenylprop-2-ynylamino)-1H-1,2,4-triazole-5-thione Formula: C12H12N4S MolecularWeight: 244.31548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1NCC#CC2=CC=CC=C2

Isomeric SMILES

CC1=NNC(=S)N1NCC#CC2=CC=CC=C2

InChI

InChI=1S/C12H12N4S/c1-10-14-15-12(17)16(10)13-9-5-8-11-6-3-2-4-7-11/h2-4,6-7,13H,9H2,1H3,(H,15,17)