methyl 2-[2-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]-1-oxopropyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C17H17BrF3N3O3S MolecularWeight: 480.29939

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C(C)N2C(=C(C(=N2)C(F)(F)F)Br)C3CC3)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C(C)N2C(=C(C(=N2)C(F)(F)F)Br)C3CC3)C(=O)OC

InChI

InChI=1S/C17H17BrF3N3O3S/c1-7-6-10(16(26)27-3)15(28-7)22-14(25)8(2)24-12(9-4-5-9)11(18)13(23-24)17(19,20)21/h6,8-9H,4-5H2,1-3H3,(H,22,25)