diethyl-[3-[1H-indol-3-ylmethyl-[(2-methylphenyl)carbamothioyl]amino]propyl]azanium

Systemtic Name: diethyl-[3-[1H-indol-3-ylmethyl-[(2-methylphenyl)carbamothioyl]amino]propyl]azanium Openeye Name: diethyl-[3-[1H-indol-3-ylmethyl(o-tolylcarbamothioyl)amino]propyl]ammonium CAS Name: diethyl-[3-[1H-indol-3-ylmethyl-[(2-methylanilino)-sulfanylidenemethyl]amino]propyl]ammonium IUPAC Name: diethyl-[3-[1H-indol-3-ylmethyl-[(2-methylphenyl)carbamothioyl]amino]propyl]azanium Traditional Name: diethyl-[3-[1H-indol-3-ylmethyl(o-tolylthiocarbamoyl)amino]propyl]ammonium Formula: C24H33N4S+ MolecularWeight: 409.61062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN(CC1=CNC2=CC=CC=C21)C(=S)NC3=CC=CC=C3C

Isomeric SMILES

CC[NH+](CC)CCCN(CC1=CNC2=CC=CC=C21)C(=S)NC3=CC=CC=C3C

InChI

InChI=1S/C24H32N4S/c1-4-27(5-2)15-10-16-28(24(29)26-22-13-8-6-11-19(22)3)18-20-17-25-23-14-9-7-12-21(20)23/h6-9,11-14,17,25H,4-5,10,15-16,18H2,1-3H3,(H,26,29)/p+1