[1-[(3-methoxyphenyl)carbamothioyl]piperidin-4-yl]-methyl-propan-2-yl-azanium

Systemtic Name: [1-[(3-methoxyphenyl)carbamothioyl]piperidin-4-yl]-methyl-propan-2-yl-azanium Openeye Name: isopropyl-[1-[(3-methoxyphenyl)carbamothioyl]-4-piperidyl]-methyl-ammonium CAS Name: [1-[(3-methoxyanilino)-sulfanylidenemethyl]-4-piperidinyl]-methyl-propan-2-ylammonium IUPAC Name: [1-[(3-methoxyphenyl)carbamothioyl]piperidin-4-yl]-methyl-propan-2-ylazanium Traditional Name: isopropyl-[1-[(3-methoxyphenyl)thiocarbamoyl]-4-piperidyl]-methyl-ammonium Formula: C17H28N3OS+ MolecularWeight: 322.48872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3OS/c1-13(2)19(3)15-8-10-20(11-9-15)17(22)18-14-6-5-7-16(12-14)21-4/h5-7,12-13,15H,8-11H2,1-4H3,(H,18,22)/p+1