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

Systemtic Name: methyl 5-methyl-2-[[2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl]carbamothioylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 5-methyl-2-[[2-oxo-4-(trifluoromethyl)chromen-7-yl]carbamothioylamino]-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-2-[[[[2-oxo-4-(trifluoromethyl)-1-benzopyran-7-yl]amino]-sulfanylidenemethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-2-[[2-oxo-4-(trifluoromethyl)chromen-7-yl]carbamothioylamino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-keto-4-(trifluoromethyl)chromen-7-yl]thiocarbamoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C24H17F3N2O4S2 MolecularWeight: 518.52799

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=S)NC2=CC3=C(C=C2)C(=CC(=O)O3)C(F)(F)F)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C(S1)NC(=S)NC2=CC3=C(C=C2)C(=CC(=O)O3)C(F)(F)F)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C24H17F3N2O4S2/c1-12-19(13-6-4-3-5-7-13)20(22(31)32-2)21(35-12)29-23(34)28-14-8-9-15-16(24(25,26)27)11-18(30)33-17(15)10-14/h3-11H,1-2H3,(H2,28,29,34)