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

Systemtic Name: 1-[[2,2-dimethyl-4-(2-oxidanylidenepyridin-1-yl)-6-(trifluoromethyl)chromen-3-yl]methyl]-3-ethyl-1-methyl-thiourea Openeye Name: 1-[[2,2-dimethyl-4-(2-oxo-1-pyridyl)-6-(trifluoromethyl)chromen-3-yl]methyl]-3-ethyl-1-methyl-thiourea CAS Name: 1-[[2,2-dimethyl-4-(2-oxo-1-pyridinyl)-6-(trifluoromethyl)-1-benzopyran-3-yl]methyl]-3-ethyl-1-methylthiourea IUPAC Name: 1-[[2,2-dimethyl-4-(2-oxopyridin-1-yl)-6-(trifluoromethyl)chromen-3-yl]methyl]-3-ethyl-1-methylthiourea Traditional Name: 3-ethyl-1-[[4-(2-keto-1-pyridyl)-2,2-dimethyl-6-(trifluoromethyl)chromen-3-yl]methyl]-1-methyl-thiourea Formula: C22H24F3N3O2S MolecularWeight: 451.50507

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N(C)CC1=C(C2=C(C=CC(=C2)C(F)(F)F)OC1(C)C)N3C=CC=CC3=O

Isomeric SMILES

CCNC(=S)N(C)CC1=C(C2=C(C=CC(=C2)C(F)(F)F)OC1(C)C)N3C=CC=CC3=O

InChI

InChI=1S/C22H24F3N3O2S/c1-5-26-20(31)27(4)13-16-19(28-11-7-6-8-18(28)29)15-12-14(22(23,24)25)9-10-17(15)30-21(16,2)3/h6-12H,5,13H2,1-4H3,(H,26,31)