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

Systemtic Name: butyl-[1-[(5-chloranyl-2-methoxy-phenyl)carbamothioyl]piperidin-4-yl]-methyl-azanium Openeye Name: butyl-[1-[(5-chloro-2-methoxy-phenyl)carbamothioyl]-4-piperidyl]-methyl-ammonium CAS Name: butyl-[1-[(5-chloro-2-methoxyanilino)-sulfanylidenemethyl]-4-piperidinyl]-methylammonium IUPAC Name: butyl-[1-[(5-chloro-2-methoxyphenyl)carbamothioyl]piperidin-4-yl]-methylazanium Traditional Name: butyl-[1-[(5-chloro-2-methoxy-phenyl)thiocarbamoyl]-4-piperidyl]-methyl-ammonium Formula: C18H29ClN3OS+ MolecularWeight: 370.96036

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)C1CCN(CC1)C(=S)NC2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CCCC[NH+](C)C1CCN(CC1)C(=S)NC2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C18H28ClN3OS/c1-4-5-10-21(2)15-8-11-22(12-9-15)18(24)20-16-13-14(19)6-7-17(16)23-3/h6-7,13,15H,4-5,8-12H2,1-3H3,(H,20,24)/p+1