[1-[(2,4-dimethylphenyl)carbamothioyl]piperidin-4-yl]-methyl-propan-2-yl-azanium

Systemtic Name: [1-[(2,4-dimethylphenyl)carbamothioyl]piperidin-4-yl]-methyl-propan-2-yl-azanium Openeye Name: [1-[(2,4-dimethylphenyl)carbamothioyl]-4-piperidyl]-isopropyl-methyl-ammonium CAS Name: [1-[(2,4-dimethylanilino)-sulfanylidenemethyl]-4-piperidinyl]-methyl-propan-2-ylammonium IUPAC Name: [1-[(2,4-dimethylphenyl)carbamothioyl]piperidin-4-yl]-methyl-propan-2-ylazanium Traditional Name: [1-[(2,4-dimethylphenyl)thiocarbamoyl]-4-piperidyl]-isopropyl-methyl-ammonium Formula: C18H30N3S+ MolecularWeight: 320.5159

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29N3S/c1-13(2)20(5)16-8-10-21(11-9-16)18(22)19-17-7-6-14(3)12-15(17)4/h6-7,12-13,16H,8-11H2,1-5H3,(H,19,22)/p+1