1-[1-(3-fluoranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)propylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-[1-(3-fluoranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)propylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[1-(3-fluoro-6-oxo-cyclohexa-2,4-dien-1-ylidene)propylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[1-(3-fluoro-6-oxo-1-cyclohexa-2,4-dienylidene)propylamino]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[1-(3-fluoro-6-oxocyclohexa-2,4-dien-1-ylidene)propylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[1-(3-fluoro-6-keto-cyclohexa-2,4-dien-1-ylidene)propylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C16H24FN4O2S+ MolecularWeight: 355.450763

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C=C(C=CC1=O)F)NNC(=S)NCC[NH+]2CCOCC2

Isomeric SMILES

CCC(=C1C=C(C=CC1=O)F)NNC(=S)NCC[NH+]2CCOCC2

InChI

InChI=1S/C16H23FN4O2S/c1-2-14(13-11-12(17)3-4-15(13)22)19-20-16(24)18-5-6-21-7-9-23-10-8-21/h3-4,11,19H,2,5-10H2,1H3,(H2,18,20,24)/p+1