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(4-cyclohexyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-methyl-[2-oxidanylidene-2-(propylamino)ethyl]azanium

(4-cyclohexyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-methyl-[2-oxidanylidene-2-(propylamino)ethyl]azanium

Systemtic Name:(4-cyclohexyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-methyl-[2-oxidanylidene-2-(propylamino)ethyl]azanium
Openeye Name:(4-cyclohexyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl-methyl-[2-oxo-2-(propylamino)ethyl]ammonium
CAS Name:(4-cyclohexyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-methyl-[2-oxo-2-(propylamino)ethyl]ammonium
IUPAC Name:(4-cyclohexyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-methyl-[2-oxo-2-(propylamino)ethyl]azanium
Traditional Name:(4-cyclohexyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl-[2-keto-2-(propylamino)ethyl]-methyl-ammonium
Formula: C16H30N5OS+
MolecularWeight: 340.5073
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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+](C)CN1C(=S)N(C(=N1)C)C2CCCCC2


Isomeric SMILES

CCCNC(=O)C[NH+](C)CN1C(=S)N(C(=N1)C)C2CCCCC2


InChI

InChI=1S/C16H29N5OS/c1-4-10-17-15(22)11-19(3)12-20-16(23)21(13(2)18-20)14-8-6-5-7-9-14/h14H,4-12H2,1-3H3,(H,17,22)/p+1


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