1-[2-fluoranyl-5-(trifluoromethyl)phenyl]-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea

Systemtic Name: 1-[2-fluoranyl-5-(trifluoromethyl)phenyl]-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea Openeye Name: 1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-(4-methyl-2-oxo-chromen-7-yl)thiourea CAS Name: 1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-(4-methyl-2-oxo-1-benzopyran-7-yl)thiourea IUPAC Name: 1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-(4-methyl-2-oxochromen-7-yl)thiourea Traditional Name: 1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-(2-keto-4-methyl-chromen-7-yl)thiourea Formula: C18H12F4N2O2S MolecularWeight: 396.358693

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC3=C(C=CC(=C3)C(F)(F)F)F

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC3=C(C=CC(=C3)C(F)(F)F)F

InChI

InChI=1S/C18H12F4N2O2S/c1-9-6-16(25)26-15-8-11(3-4-12(9)15)23-17(27)24-14-7-10(18(20,21)22)2-5-13(14)19/h2-8H,1H3,(H2,23,24,27)