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

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-[(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-[(3-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-[(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-[(3-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Formula: C15H14FN3O2S MolecularWeight: 319.353963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=S)NNC=C2C=CC(=O)C(=C2)O)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=S)NNC=C2C=CC(=O)C(=C2)O)F

InChI

InChI=1S/C15H14FN3O2S/c16-12-4-1-10(2-5-12)8-17-15(22)19-18-9-11-3-6-13(20)14(21)7-11/h1-7,9,18,21H,8H2,(H2,17,19,22)