1-[(4-fluorophenyl)methyl]-3-[1-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-[1-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-[1-(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[1-(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)ethylamino]thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-[1-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-[1-(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Formula: C16H16FN3O2S MolecularWeight: 333.380543

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC(=O)C=C1O)NNC(=S)NCC2=CC=C(C=C2)F

Isomeric SMILES

CC(=C1C=CC(=O)C=C1O)NNC(=S)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C16H16FN3O2S/c1-10(14-7-6-13(21)8-15(14)22)19-20-16(23)18-9-11-2-4-12(17)5-3-11/h2-8,19,22H,9H2,1H3,(H2,18,20,23)