ethyl-[[5-(methylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]-(phenylmethyl)azanium

Systemtic Name: ethyl-[[5-(methylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]-(phenylmethyl)azanium Openeye Name: benzyl-ethyl-[[5-(methylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]ammonium CAS Name: ethyl-[[5-(methylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-ethyl-[[5-(methylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]azanium Traditional Name: benzyl-ethyl-[[5-(methylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]ammonium Formula: C13H19N4S2+ MolecularWeight: 295.44676

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CN2C(=S)SC(=N2)NC

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CN2C(=S)SC(=N2)NC

InChI

InChI=1S/C13H18N4S2/c1-3-16(9-11-7-5-4-6-8-11)10-17-13(18)19-12(14-2)15-17/h4-8H,3,9-10H2,1-2H3,(H,14,15)/p+1