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

Systemtic Name: 2-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione Openeye Name: 2-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]-5-(2-thienyl)-1H-1,2,4-triazole-3-thione CAS Name: 2-[[methyl-[[4-(methylthio)phenyl]methyl]amino]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione Traditional Name: 2-[[methyl-[4-(methylthio)benzyl]amino]methyl]-5-(2-thienyl)-1H-1,2,4-triazole-3-thione Formula: C16H18N4S3 MolecularWeight: 362.53592

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)CN2C(=S)N=C(N2)C3=CC=CS3

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)CN2C(=S)N=C(N2)C3=CC=CS3

InChI

InChI=1S/C16H18N4S3/c1-19(10-12-5-7-13(22-2)8-6-12)11-20-16(21)17-15(18-20)14-4-3-9-23-14/h3-9H,10-11H2,1-2H3,(H,17,18,21)