cyclopentyl-methyl-[1-[(3-methylphenyl)carbamothioyl]piperidin-4-yl]azanium

Systemtic Name: cyclopentyl-methyl-[1-[(3-methylphenyl)carbamothioyl]piperidin-4-yl]azanium Openeye Name: cyclopentyl-methyl-[1-(m-tolylcarbamothioyl)-4-piperidyl]ammonium CAS Name: cyclopentyl-methyl-[1-[(3-methylanilino)-sulfanylidenemethyl]-4-piperidinyl]ammonium IUPAC Name: cyclopentyl-methyl-[1-[(3-methylphenyl)carbamothioyl]piperidin-4-yl]azanium Traditional Name: cyclopentyl-methyl-[1-(m-tolylthiocarbamoyl)-4-piperidyl]ammonium Formula: C19H30N3S+ MolecularWeight: 332.5266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N2CCC(CC2)[NH+](C)C3CCCC3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N2CCC(CC2)[NH+](C)C3CCCC3

InChI

InChI=1S/C19H29N3S/c1-15-6-5-7-16(14-15)20-19(23)22-12-10-18(11-13-22)21(2)17-8-3-4-9-17/h5-7,14,17-18H,3-4,8-13H2,1-2H3,(H,20,23)/p+1