methyl-[(4-methylphenyl)methyl]-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]azanium

Systemtic Name: methyl-[(4-methylphenyl)methyl]-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]azanium Openeye Name: methyl-(p-tolylmethyl)-[[5-(2-thienyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]ammonium CAS Name: methyl-[(4-methylphenyl)methyl]-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]ammonium IUPAC Name: methyl-[(4-methylphenyl)methyl]-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]azanium Traditional Name: methyl-(4-methylbenzyl)-[[5-(2-thienyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]ammonium Formula: C16H19N4S2+ MolecularWeight: 331.47886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+](C)CN2C(=S)N=C(N2)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+](C)CN2C(=S)N=C(N2)C3=CC=CS3

InChI

InChI=1S/C16H18N4S2/c1-12-5-7-13(8-6-12)10-19(2)11-20-16(21)17-15(18-20)14-4-3-9-22-14/h3-9H,10-11H2,1-2H3,(H,17,18,21)/p+1