1-(3-ethylphenyl)-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)thiourea

Systemtic Name: 1-(3-ethylphenyl)-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)thiourea Openeye Name: 1-(3-ethylphenyl)-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)thiourea CAS Name: 1-[[(3-ethylanilino)-sulfanylidenemethyl]amino]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-(3-ethylphenyl)-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)thiourea Traditional Name: 1-(3-ethylphenyl)-3-(2-morpholin-4-ium-4-ylethylthiocarbamoylamino)thiourea Formula: C16H26N5OS2+ MolecularWeight: 368.54054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)NNC(=S)NCC[NH+]2CCOCC2

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)NNC(=S)NCC[NH+]2CCOCC2

InChI

InChI=1S/C16H25N5OS2/c1-2-13-4-3-5-14(12-13)18-16(24)20-19-15(23)17-6-7-21-8-10-22-11-9-21/h3-5,12H,2,6-11H2,1H3,(H2,17,19,23)(H2,18,20,24)/p+1