[1-[(3-chloranyl-4-methyl-phenyl)carbamothioyl]piperidin-4-yl]-cyclopentyl-methyl-azanium

Systemtic Name: [1-[(3-chloranyl-4-methyl-phenyl)carbamothioyl]piperidin-4-yl]-cyclopentyl-methyl-azanium Openeye Name: [1-[(3-chloro-4-methyl-phenyl)carbamothioyl]-4-piperidyl]-cyclopentyl-methyl-ammonium CAS Name: [1-[(3-chloro-4-methylanilino)-sulfanylidenemethyl]-4-piperidinyl]-cyclopentyl-methylammonium IUPAC Name: [1-[(3-chloro-4-methylphenyl)carbamothioyl]piperidin-4-yl]-cyclopentyl-methylazanium Traditional Name: [1-[(3-chloro-4-methyl-phenyl)thiocarbamoyl]-4-piperidyl]-cyclopentyl-methyl-ammonium Formula: C19H29ClN3S+ MolecularWeight: 366.97166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N2CCC(CC2)[NH+](C)C3CCCC3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N2CCC(CC2)[NH+](C)C3CCCC3)Cl

InChI

InChI=1S/C19H28ClN3S/c1-14-7-8-15(13-18(14)20)21-19(24)23-11-9-17(10-12-23)22(2)16-5-3-4-6-16/h7-8,13,16-17H,3-6,9-12H2,1-2H3,(H,21,24)/p+1