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

Systemtic Name: methyl-[(2-methylphenyl)methyl]-[(4-propyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Openeye Name: methyl-(o-tolylmethyl)-[[4-propyl-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]ammonium CAS Name: methyl-[(2-methylphenyl)methyl]-[(4-propyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]ammonium IUPAC Name: methyl-[(2-methylphenyl)methyl]-[(4-propyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Traditional Name: methyl-(2-methylbenzyl)-[[4-propyl-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]ammonium Formula: C20H26N5S+ MolecularWeight: 368.51894

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN(C1=S)C[NH+](C)CC2=CC=CC=C2C)C3=CC=NC=C3

Isomeric SMILES

CCCN1C(=NN(C1=S)C[NH+](C)CC2=CC=CC=C2C)C3=CC=NC=C3

InChI

InChI=1S/C20H25N5S/c1-4-13-24-19(17-9-11-21-12-10-17)22-25(20(24)26)15-23(3)14-18-8-6-5-7-16(18)2/h5-12H,4,13-15H2,1-3H3/p+1