1-[[2,2-dimethyl-4-(3-oxidanylidene-1H-isoindol-2-yl)-6-(trifluoromethyl)chromen-3-yl]methyl]-3-ethyl-thiourea

Systemtic Name: 1-[[2,2-dimethyl-4-(3-oxidanylidene-1H-isoindol-2-yl)-6-(trifluoromethyl)chromen-3-yl]methyl]-3-ethyl-thiourea Openeye Name: 1-[[2,2-dimethyl-4-(1-oxoisoindolin-2-yl)-6-(trifluoromethyl)chromen-3-yl]methyl]-3-ethyl-thiourea CAS Name: 1-[[2,2-dimethyl-4-(3-oxo-1H-isoindol-2-yl)-6-(trifluoromethyl)-1-benzopyran-3-yl]methyl]-3-ethylthiourea IUPAC Name: 1-[[2,2-dimethyl-4-(3-oxo-1H-isoindol-2-yl)-6-(trifluoromethyl)chromen-3-yl]methyl]-3-ethylthiourea Traditional Name: 1-ethyl-3-[[4-(1-ketoisoindolin-2-yl)-2,2-dimethyl-6-(trifluoromethyl)chromen-3-yl]methyl]thiourea Formula: C24H24F3N3O2S MolecularWeight: 475.52647

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NCC1=C(C2=C(C=CC(=C2)C(F)(F)F)OC1(C)C)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

CCNC(=S)NCC1=C(C2=C(C=CC(=C2)C(F)(F)F)OC1(C)C)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C24H24F3N3O2S/c1-4-28-22(33)29-12-18-20(30-13-14-7-5-6-8-16(14)21(30)31)17-11-15(24(25,26)27)9-10-19(17)32-23(18,2)3/h5-11H,4,12-13H2,1-3H3,(H2,28,29,33)