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

Systemtic Name: [1-[(3-chloranyl-4-methoxy-phenyl)carbamothioyl]piperidin-4-yl]-methyl-propan-2-yl-azanium Openeye Name: [1-[(3-chloro-4-methoxy-phenyl)carbamothioyl]-4-piperidyl]-isopropyl-methyl-ammonium CAS Name: [1-[(3-chloro-4-methoxyanilino)-sulfanylidenemethyl]-4-piperidinyl]-methyl-propan-2-ylammonium IUPAC Name: [1-[(3-chloro-4-methoxyphenyl)carbamothioyl]piperidin-4-yl]-methyl-propan-2-ylazanium Traditional Name: [1-[(3-chloro-4-methoxy-phenyl)thiocarbamoyl]-4-piperidyl]-isopropyl-methyl-ammonium Formula: C17H27ClN3OS+ MolecularWeight: 356.93378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26ClN3OS/c1-12(2)20(3)14-7-9-21(10-8-14)17(23)19-13-5-6-16(22-4)15(18)11-13/h5-6,11-12,14H,7-10H2,1-4H3,(H,19,23)/p+1