1-(2-morpholin-4-ium-4-ylethyl)-3-(phenethylcarbamothioylamino)thiourea

Systemtic Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-(phenethylcarbamothioylamino)thiourea Openeye Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-(phenethylcarbamothioylamino)thiourea CAS Name: 1-[2-(4-morpholin-4-iumyl)ethyl]-3-[[(phenethylamino)-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-(phenethylcarbamothioylamino)thiourea Traditional Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-(phenethylthiocarbamoylamino)thiourea Formula: C16H26N5OS2+ MolecularWeight: 368.54054

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)NNC(=S)NCCC2=CC=CC=C2

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)NNC(=S)NCCC2=CC=CC=C2

InChI

InChI=1S/C16H25N5OS2/c23-15(17-7-6-14-4-2-1-3-5-14)19-20-16(24)18-8-9-21-10-12-22-13-11-21/h1-5H,6-13H2,(H2,17,19,23)(H2,18,20,24)/p+1