1-ethyl-3-[2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl]thiourea

Systemtic Name: 1-ethyl-3-[2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl]thiourea Openeye Name: 1-ethyl-3-[2-oxo-4-(trifluoromethyl)chromen-7-yl]thiourea CAS Name: 1-ethyl-3-[2-oxo-4-(trifluoromethyl)-1-benzopyran-7-yl]thiourea IUPAC Name: 1-ethyl-3-[2-oxo-4-(trifluoromethyl)chromen-7-yl]thiourea Traditional Name: 1-ethyl-3-[2-keto-4-(trifluoromethyl)chromen-7-yl]thiourea Formula: C13H11F3N2O2S MolecularWeight: 316.29885

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F

Isomeric SMILES

CCNC(=S)NC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F

InChI

InChI=1S/C13H11F3N2O2S/c1-2-17-12(21)18-7-3-4-8-9(13(14,15)16)6-11(19)20-10(8)5-7/h3-6H,2H2,1H3,(H2,17,18,21)