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

Systemtic Name: 1-(2-fluorophenyl)-3-[1-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea Openeye Name: 1-(2-fluorophenyl)-3-[1-(3-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea CAS Name: 1-(2-fluorophenyl)-3-[1-(3-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)ethylamino]thiourea IUPAC Name: 1-(2-fluorophenyl)-3-[1-(3-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea Traditional Name: 1-(2-fluorophenyl)-3-[1-(6-keto-3-methyl-cyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea Formula: C16H16FN3OS MolecularWeight: 317.381143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C)NNC(=S)NC2=CC=CC=C2F)C(=O)C=C1

Isomeric SMILES

CC1=CC(=C(C)NNC(=S)NC2=CC=CC=C2F)C(=O)C=C1

InChI

InChI=1S/C16H16FN3OS/c1-10-7-8-15(21)12(9-10)11(2)19-20-16(22)18-14-6-4-3-5-13(14)17/h3-9,19H,1-2H3,(H2,18,20,22)