dimethyl-[(1R)-1-(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)propyl]azanium

Systemtic Name: dimethyl-[(1R)-1-(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)propyl]azanium Openeye Name: dimethyl-[(1R)-1-(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)propyl]ammonium CAS Name: dimethyl-[(1R)-1-(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)propyl]ammonium IUPAC Name: dimethyl-[(1R)-1-(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)propyl]azanium Traditional Name: dimethyl-[(1R)-1-(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)propyl]ammonium Formula: C13H19N4S+ MolecularWeight: 263.38176

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NNC(=S)N1C2=CC=CC=C2)[NH+](C)C

Isomeric SMILES

CC[C@H](C1=NNC(=S)N1C2=CC=CC=C2)[NH+](C)C

InChI

InChI=1S/C13H18N4S/c1-4-11(16(2)3)12-14-15-13(18)17(12)10-8-6-5-7-9-10/h5-9,11H,4H2,1-3H3,(H,15,18)/p+1/t11-/m1/s1