5-(4-ethylphenyl)-2-[[methyl(thiophen-3-ylmethyl)amino]methyl]-1H-1,2,4-triazole-3-thione

Systemtic Name: 5-(4-ethylphenyl)-2-[[methyl(thiophen-3-ylmethyl)amino]methyl]-1H-1,2,4-triazole-3-thione Openeye Name: 5-(4-ethylphenyl)-2-[[methyl(3-thienylmethyl)amino]methyl]-1H-1,2,4-triazole-3-thione CAS Name: 5-(4-ethylphenyl)-2-[[methyl(3-thiophenylmethyl)amino]methyl]-1H-1,2,4-triazole-3-thione IUPAC Name: 5-(4-ethylphenyl)-2-[[methyl(thiophen-3-ylmethyl)amino]methyl]-1H-1,2,4-triazole-3-thione Traditional Name: 5-(4-ethylphenyl)-2-[[methyl(3-thenyl)amino]methyl]-1H-1,2,4-triazole-3-thione Formula: C17H20N4S2 MolecularWeight: 344.4975

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=S)N(N2)CN(C)CC3=CSC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=S)N(N2)CN(C)CC3=CSC=C3

InChI

InChI=1S/C17H20N4S2/c1-3-13-4-6-15(7-5-13)16-18-17(22)21(19-16)12-20(2)10-14-8-9-23-11-14/h4-9,11H,3,10,12H2,1-2H3,(H,18,19,22)