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

Systemtic Name: methyl-[1-[(3-methylsulfanylphenyl)carbamothioyl]piperidin-4-yl]-propan-2-yl-azanium Openeye Name: isopropyl-methyl-[1-[(3-methylsulfanylphenyl)carbamothioyl]-4-piperidyl]ammonium CAS Name: methyl-[1-[[3-(methylthio)anilino]-sulfanylidenemethyl]-4-piperidinyl]-propan-2-ylammonium IUPAC Name: methyl-[1-[(3-methylsulfanylphenyl)carbamothioyl]piperidin-4-yl]-propan-2-ylazanium Traditional Name: isopropyl-methyl-[1-[[3-(methylthio)phenyl]thiocarbamoyl]-4-piperidyl]ammonium Formula: C17H28N3S2+ MolecularWeight: 338.55432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3S2/c1-13(2)19(3)15-8-10-20(11-9-15)17(21)18-14-6-5-7-16(12-14)22-4/h5-7,12-13,15H,8-11H2,1-4H3,(H,18,21)/p+1