1-(2,6-dimethylphenyl)-3-[1-(3-fluoranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea

Systemtic Name: 1-(2,6-dimethylphenyl)-3-[1-(3-fluoranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea Openeye Name: 1-(2,6-dimethylphenyl)-3-[1-(3-fluoro-6-oxo-cyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea CAS Name: 1-(2,6-dimethylphenyl)-3-[1-(3-fluoro-6-oxo-1-cyclohexa-2,4-dienylidene)ethylamino]thiourea IUPAC Name: 1-(2,6-dimethylphenyl)-3-[1-(3-fluoro-6-oxocyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea Traditional Name: 1-(2,6-dimethylphenyl)-3-[1-(3-fluoro-6-keto-cyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea Formula: C17H18FN3OS MolecularWeight: 331.407723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)NNC(=C2C=C(C=CC2=O)F)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)NNC(=C2C=C(C=CC2=O)F)C

InChI

InChI=1S/C17H18FN3OS/c1-10-5-4-6-11(2)16(10)19-17(23)21-20-12(3)14-9-13(18)7-8-15(14)22/h4-9,20H,1-3H3,(H2,19,21,23)