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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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