[1-[(3-chloranyl-2-methyl-phenyl)carbamothioyl]piperidin-4-yl]-cyclopentyl-methyl-azanium

Systemtic Name: [1-[(3-chloranyl-2-methyl-phenyl)carbamothioyl]piperidin-4-yl]-cyclopentyl-methyl-azanium Openeye Name: [1-[(3-chloro-2-methyl-phenyl)carbamothioyl]-4-piperidyl]-cyclopentyl-methyl-ammonium CAS Name: [1-[(3-chloro-2-methylanilino)-sulfanylidenemethyl]-4-piperidinyl]-cyclopentyl-methylammonium IUPAC Name: [1-[(3-chloro-2-methylphenyl)carbamothioyl]piperidin-4-yl]-cyclopentyl-methylazanium Traditional Name: [1-[(3-chloro-2-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=CC=C1Cl)NC(=S)N2CCC(CC2)[NH+](C)C3CCCC3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)N2CCC(CC2)[NH+](C)C3CCCC3

InChI

InChI=1S/C19H28ClN3S/c1-14-17(20)8-5-9-18(14)21-19(24)23-12-10-16(11-13-23)22(2)15-6-3-4-7-15/h5,8-9,15-16H,3-4,6-7,10-13H2,1-2H3,(H,21,24)/p+1