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

Systemtic Name: 1-(4-fluorophenyl)-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)thiourea Openeye Name: 1-(4-fluorophenyl)-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)thiourea CAS Name: 1-[[(4-fluoroanilino)-sulfanylidenemethyl]amino]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-(4-fluorophenyl)-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)thiourea Traditional Name: 1-(4-fluorophenyl)-3-(2-morpholin-4-ium-4-ylethylthiocarbamoylamino)thiourea Formula: C14H21FN5OS2+ MolecularWeight: 358.477843

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)NNC(=S)NC2=CC=C(C=C2)F

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)NNC(=S)NC2=CC=C(C=C2)F

InChI

InChI=1S/C14H20FN5OS2/c15-11-1-3-12(4-2-11)17-14(23)19-18-13(22)16-5-6-20-7-9-21-10-8-20/h1-4H,5-10H2,(H2,16,18,22)(H2,17,19,23)/p+1