methyl-[1-[(3-methylphenyl)carbamothioyl]piperidin-4-yl]-(oxolan-2-ylmethyl)azanium

Systemtic Name: methyl-[1-[(3-methylphenyl)carbamothioyl]piperidin-4-yl]-(oxolan-2-ylmethyl)azanium Openeye Name: methyl-[1-(m-tolylcarbamothioyl)-4-piperidyl]-(tetrahydrofuran-2-ylmethyl)ammonium CAS Name: methyl-[1-[(3-methylanilino)-sulfanylidenemethyl]-4-piperidinyl]-(2-oxolanylmethyl)ammonium IUPAC Name: methyl-[1-[(3-methylphenyl)carbamothioyl]piperidin-4-yl]-(oxolan-2-ylmethyl)azanium Traditional Name: methyl-[1-(m-tolylthiocarbamoyl)-4-piperidyl]-(tetrahydrofurfuryl)ammonium Formula: C19H30N3OS+ MolecularWeight: 348.526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N2CCC(CC2)[NH+](C)CC3CCCO3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N2CCC(CC2)[NH+](C)CC3CCCO3

InChI

InChI=1S/C19H29N3OS/c1-15-5-3-6-16(13-15)20-19(24)22-10-8-17(9-11-22)21(2)14-18-7-4-12-23-18/h3,5-6,13,17-18H,4,7-12,14H2,1-2H3,(H,20,24)/p+1