dimethyl-[[4-[[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]methyl]phenyl]methyl]azanium

Systemtic Name: dimethyl-[[4-[[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]methyl]phenyl]methyl]azanium Openeye Name: dimethyl-[[4-[[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]methyl]phenyl]methyl]ammonium CAS Name: dimethyl-[[4-[[[[[(1S,2S)-2-methylcyclohexyl]amino]-sulfanylidenemethyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: dimethyl-[[4-[[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]methyl]phenyl]methyl]azanium Traditional Name: dimethyl-[4-[[[(1S,2S)-2-methylcyclohexyl]thiocarbamoylamino]methyl]benzyl]ammonium Formula: C18H30N3S+ MolecularWeight: 320.5159

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NCC2=CC=C(C=C2)C[NH+](C)C

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NCC2=CC=C(C=C2)C[NH+](C)C

InChI

InChI=1S/C18H29N3S/c1-14-6-4-5-7-17(14)20-18(22)19-12-15-8-10-16(11-9-15)13-21(2)3/h8-11,14,17H,4-7,12-13H2,1-3H3,(H2,19,20,22)/p+1/t14-,17-/m0/s1