methyl 6-[2-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]ethanoylamino]-3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 6-[2-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]ethanoylamino]-3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: methyl 6-[[2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]-3-chloro-benzothiophene-2-carboxylate CAS Name: 6-[[2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]-1-oxoethyl]amino]-3-chloro-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 6-[[2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]-3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 6-[[2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]-3-chloro-benzothiophene-2-carboxylic acid methyl ester Formula: C19H14BrClF3N3O3S MolecularWeight: 536.74997

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(S1)C=C(C=C2)NC(=O)CN3C(=C(C(=N3)C(F)(F)F)Br)C4CC4)Cl

Isomeric SMILES

COC(=O)C1=C(C2=C(S1)C=C(C=C2)NC(=O)CN3C(=C(C(=N3)C(F)(F)F)Br)C4CC4)Cl

InChI

InChI=1S/C19H14BrClF3N3O3S/c1-30-18(29)16-14(21)10-5-4-9(6-11(10)31-16)25-12(28)7-27-15(8-2-3-8)13(20)17(26-27)19(22,23)24/h4-6,8H,2-3,7H2,1H3,(H,25,28)