cyclohexyl-methyl-[1-[(2,4,6-trimethylphenyl)carbamothioyl]piperidin-4-yl]azanium

Systemtic Name: cyclohexyl-methyl-[1-[(2,4,6-trimethylphenyl)carbamothioyl]piperidin-4-yl]azanium Openeye Name: cyclohexyl-methyl-[1-[(2,4,6-trimethylphenyl)carbamothioyl]-4-piperidyl]ammonium CAS Name: cyclohexyl-methyl-[1-[sulfanylidene-(2,4,6-trimethylanilino)methyl]-4-piperidinyl]ammonium IUPAC Name: cyclohexyl-methyl-[1-[(2,4,6-trimethylphenyl)carbamothioyl]piperidin-4-yl]azanium Traditional Name: cyclohexyl-[1-(mesitylthiocarbamoyl)-4-piperidyl]-methyl-ammonium Formula: C22H36N3S+ MolecularWeight: 374.60634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=S)N2CCC(CC2)[NH+](C)C3CCCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=S)N2CCC(CC2)[NH+](C)C3CCCCC3)C

InChI

InChI=1S/C22H35N3S/c1-16-14-17(2)21(18(3)15-16)23-22(26)25-12-10-20(11-13-25)24(4)19-8-6-5-7-9-19/h14-15,19-20H,5-13H2,1-4H3,(H,23,26)/p+1