ethyl-[(4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-(phenylmethyl)azanium

Systemtic Name: ethyl-[(4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-(phenylmethyl)azanium Openeye Name: benzyl-ethyl-[(4-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]ammonium CAS Name: ethyl-[(4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-ethyl-[(4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Traditional Name: benzyl-ethyl-[(4-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]ammonium Formula: C13H19N4S+ MolecularWeight: 263.38176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N4S/c1-3-16(9-12-7-5-4-6-8-12)11-17-13(18)15(2)10-14-17/h4-8,10H,3,9,11H2,1-2H3/p+1