methyl 5-(dimethylcarbamoyl)-4-methyl-2-[[2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl]carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[[2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl]carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[[2-oxo-4-(trifluoromethyl)chromen-7-yl]carbamothioylamino]thiophene-3-carboxylate CAS Name: 5-[dimethylamino(oxo)methyl]-4-methyl-2-[[[[2-oxo-4-(trifluoromethyl)-1-benzopyran-7-yl]amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[[2-oxo-4-(trifluoromethyl)chromen-7-yl]carbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-(dimethylcarbamoyl)-2-[[2-keto-4-(trifluoromethyl)chromen-7-yl]thiocarbamoylamino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C21H18F3N3O5S2 MolecularWeight: 513.50993

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC3=C(C=C2)C(=CC(=O)O3)C(F)(F)F)C(=O)N(C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC3=C(C=C2)C(=CC(=O)O3)C(F)(F)F)C(=O)N(C)C

InChI

InChI=1S/C21H18F3N3O5S2/c1-9-15(19(30)31-4)17(34-16(9)18(29)27(2)3)26-20(33)25-10-5-6-11-12(21(22,23)24)8-14(28)32-13(11)7-10/h5-8H,1-4H3,(H2,25,26,33)