methyl 4-aminocarbonyl-3-methyl-5-[2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 4-aminocarbonyl-3-methyl-5-[2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 4-carbamoyl-3-methyl-5-[[2-[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetyl]amino]thiophene-2-carboxylate CAS Name: 4-carbamoyl-3-methyl-5-[[1-oxo-2-[[4-thiophen-2-yl-6-(trifluoromethyl)-2-pyrimidinyl]thio]ethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-carbamoyl-3-methyl-5-[[2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetyl]amino]thiophene-2-carboxylate Traditional Name: 4-carbamoyl-3-methyl-5-[[2-[[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C19H15F3N4O4S3 MolecularWeight: 516.53701

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)CSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CS3)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)CSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C19H15F3N4O4S3/c1-8-13(15(23)28)16(33-14(8)17(29)30-2)26-12(27)7-32-18-24-9(10-4-3-5-31-10)6-11(25-18)19(20,21)22/h3-6H,7H2,1-2H3,(H2,23,28)(H,26,27)