1-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[(3-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[(3-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[(3-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C16H13BrF3N3O2S MolecularWeight: 448.25753

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC(=S)NC2=CC=CC=C2C(F)(F)F)C=C(C1=O)Br

Isomeric SMILES

COC1=CC(=CNNC(=S)NC2=CC=CC=C2C(F)(F)F)C=C(C1=O)Br

InChI

InChI=1S/C16H13BrF3N3O2S/c1-25-13-7-9(6-11(17)14(13)24)8-21-23-15(26)22-12-5-3-2-4-10(12)16(18,19)20/h2-8,21H,1H3,(H2,22,23,26)