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

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[[[2-(4-morpholin-4-iumyl)ethylamino]-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-(2-morpholin-4-ium-4-ylethylcarbamothioylamino)thiourea Traditional Name: 1-(4-fluorobenzyl)-3-(2-morpholin-4-ium-4-ylethylthiocarbamoylamino)thiourea Formula: C15H23FN5OS2+ MolecularWeight: 372.504423

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)NNC(=S)NCC2=CC=C(C=C2)F

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)NNC(=S)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C15H22FN5OS2/c16-13-3-1-12(2-4-13)11-18-15(24)20-19-14(23)17-5-6-21-7-9-22-10-8-21/h1-4H,5-11H2,(H2,17,19,23)(H2,18,20,24)/p+1