dimethyl-[1-[[(2-methylphenyl)carbamothioylamino]methyl]cyclohexyl]azanium

Systemtic Name: dimethyl-[1-[[(2-methylphenyl)carbamothioylamino]methyl]cyclohexyl]azanium Openeye Name: dimethyl-[1-[(o-tolylcarbamothioylamino)methyl]cyclohexyl]ammonium CAS Name: dimethyl-[1-[[[(2-methylanilino)-sulfanylidenemethyl]amino]methyl]cyclohexyl]ammonium IUPAC Name: dimethyl-[1-[[(2-methylphenyl)carbamothioylamino]methyl]cyclohexyl]azanium Traditional Name: dimethyl-[1-[(o-tolylthiocarbamoylamino)methyl]cyclohexyl]ammonium Formula: C17H28N3S+ MolecularWeight: 306.48932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NCC2(CCCCC2)[NH+](C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NCC2(CCCCC2)[NH+](C)C

InChI

InChI=1S/C17H27N3S/c1-14-9-5-6-10-15(14)19-16(21)18-13-17(20(2)3)11-7-4-8-12-17/h5-6,9-10H,4,7-8,11-13H2,1-3H3,(H2,18,19,21)/p+1