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

Systemtic Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-(2-phenylsulfanylethylcarbamothioylamino)thiourea Openeye Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-(2-phenylsulfanylethylcarbamothioylamino)thiourea CAS Name: 1-[2-(4-morpholin-4-iumyl)ethyl]-3-[[[2-(phenylthio)ethylamino]-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-(2-phenylsulfanylethylcarbamothioylamino)thiourea Traditional Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-[2-(phenylthio)ethylthiocarbamoylamino]thiourea Formula: C16H26N5OS3+ MolecularWeight: 400.60554

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)NNC(=S)NCCSC2=CC=CC=C2

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)NNC(=S)NCCSC2=CC=CC=C2

InChI

InChI=1S/C16H25N5OS3/c23-15(17-6-8-21-9-11-22-12-10-21)19-20-16(24)18-7-13-25-14-4-2-1-3-5-14/h1-5H,6-13H2,(H2,17,19,23)(H2,18,20,24)/p+1