cyclopentyl-methyl-[1-[(2,4,6-trimethylphenyl)carbamothioyl]piperidin-4-yl]azanium

Systemtic Name: cyclopentyl-methyl-[1-[(2,4,6-trimethylphenyl)carbamothioyl]piperidin-4-yl]azanium Openeye Name: cyclopentyl-methyl-[1-[(2,4,6-trimethylphenyl)carbamothioyl]-4-piperidyl]ammonium CAS Name: cyclopentyl-methyl-[1-[sulfanylidene-(2,4,6-trimethylanilino)methyl]-4-piperidinyl]ammonium IUPAC Name: cyclopentyl-methyl-[1-[(2,4,6-trimethylphenyl)carbamothioyl]piperidin-4-yl]azanium Traditional Name: cyclopentyl-[1-(mesitylthiocarbamoyl)-4-piperidyl]-methyl-ammonium Formula: C21H34N3S+ MolecularWeight: 360.57976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H33N3S/c1-15-13-16(2)20(17(3)14-15)22-21(25)24-11-9-19(10-12-24)23(4)18-7-5-6-8-18/h13-14,18-19H,5-12H2,1-4H3,(H,22,25)/p+1