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

Systemtic Name: cycloheptyl-methyl-[1-[(4-methylphenyl)carbamothioyl]piperidin-4-yl]azanium Openeye Name: cycloheptyl-methyl-[1-(p-tolylcarbamothioyl)-4-piperidyl]ammonium CAS Name: cycloheptyl-methyl-[1-[(4-methylanilino)-sulfanylidenemethyl]-4-piperidinyl]ammonium IUPAC Name: cycloheptyl-methyl-[1-[(4-methylphenyl)carbamothioyl]piperidin-4-yl]azanium Traditional Name: cycloheptyl-methyl-[1-(p-tolylthiocarbamoyl)-4-piperidyl]ammonium Formula: C21H34N3S+ MolecularWeight: 360.57976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)N2CCC(CC2)[NH+](C)C3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)N2CCC(CC2)[NH+](C)C3CCCCCC3

InChI

InChI=1S/C21H33N3S/c1-17-9-11-18(12-10-17)22-21(25)24-15-13-20(14-16-24)23(2)19-7-5-3-4-6-8-19/h9-12,19-20H,3-8,13-16H2,1-2H3,(H,22,25)/p+1