cyclohexyl-[(3S)-3-ethylsulfanyl-6-methyl-5-oxidanylidene-2,4-dihydro-1,2,4-triazin-3-yl]azanium

Systemtic Name: cyclohexyl-[(3S)-3-ethylsulfanyl-6-methyl-5-oxidanylidene-2,4-dihydro-1,2,4-triazin-3-yl]azanium Openeye Name: cyclohexyl-[(3S)-3-ethylsulfanyl-6-methyl-5-oxo-2,4-dihydro-1,2,4-triazin-3-yl]ammonium CAS Name: cyclohexyl-[(3S)-3-(ethylthio)-6-methyl-5-oxo-2,4-dihydro-1,2,4-triazin-3-yl]ammonium IUPAC Name: cyclohexyl-[(3S)-3-ethylsulfanyl-6-methyl-5-oxo-2,4-dihydro-1,2,4-triazin-3-yl]azanium Traditional Name: cyclohexyl-[(3S)-3-(ethylthio)-5-keto-6-methyl-2,4-dihydro-1,2,4-triazin-3-yl]ammonium Formula: C12H23N4OS+ MolecularWeight: 271.40222

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1(NC(=O)C(=NN1)C)[NH2+]C2CCCCC2

Isomeric SMILES

CCS[C@@]1(NC(=O)C(=NN1)C)[NH2+]C2CCCCC2

InChI

InChI=1S/C12H22N4OS/c1-3-18-12(13-10-7-5-4-6-8-10)14-11(17)9(2)15-16-12/h10,13,16H,3-8H2,1-2H3,(H,14,17)/p+1/t12-/m1/s1