diethyl-[2-[4-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)phenyl]carbonyloxyethyl]azanium

Systemtic Name: diethyl-[2-[4-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)phenyl]carbonyloxyethyl]azanium Openeye Name: diethyl-[2-[4-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)benzoyl]oxyethyl]ammonium CAS Name: diethyl-[2-[[4-[[[2-(4-morpholin-4-iumyl)ethylamino]-sulfanylidenemethyl]amino]phenyl]-oxomethoxy]ethyl]ammonium IUPAC Name: diethyl-[2-[4-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)benzoyl]oxyethyl]azanium Traditional Name: diethyl-[2-[4-(2-morpholin-4-ium-4-ylethylthiocarbamoylamino)benzoyl]oxyethyl]ammonium Formula: C20H34N4O3S+2 MolecularWeight: 410.57396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC(=O)C1=CC=C(C=C1)NC(=S)NCC[NH+]2CCOCC2

Isomeric SMILES

CC[NH+](CC)CCOC(=O)C1=CC=C(C=C1)NC(=S)NCC[NH+]2CCOCC2

InChI

InChI=1S/C20H32N4O3S/c1-3-23(4-2)13-16-27-19(25)17-5-7-18(8-6-17)22-20(28)21-9-10-24-11-14-26-15-12-24/h5-8H,3-4,9-16H2,1-2H3,(H2,21,22,28)/p+2