[1-[(5-chloranyl-2-methoxy-phenyl)carbamothioyl]piperidin-4-yl]-cyclohexyl-methyl-azanium

Systemtic Name: [1-[(5-chloranyl-2-methoxy-phenyl)carbamothioyl]piperidin-4-yl]-cyclohexyl-methyl-azanium Openeye Name: [1-[(5-chloro-2-methoxy-phenyl)carbamothioyl]-4-piperidyl]-cyclohexyl-methyl-ammonium CAS Name: [1-[(5-chloro-2-methoxyanilino)-sulfanylidenemethyl]-4-piperidinyl]-cyclohexyl-methylammonium IUPAC Name: [1-[(5-chloro-2-methoxyphenyl)carbamothioyl]piperidin-4-yl]-cyclohexyl-methylazanium Traditional Name: [1-[(5-chloro-2-methoxy-phenyl)thiocarbamoyl]-4-piperidyl]-cyclohexyl-methyl-ammonium Formula: C20H31ClN3OS+ MolecularWeight: 396.99764

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C1CCCCC1)C2CCN(CC2)C(=S)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

C[NH+](C1CCCCC1)C2CCN(CC2)C(=S)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C20H30ClN3OS/c1-23(16-6-4-3-5-7-16)17-10-12-24(13-11-17)20(26)22-18-14-15(21)8-9-19(18)25-2/h8-9,14,16-17H,3-7,10-13H2,1-2H3,(H,22,26)/p+1