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

Systemtic Name: methyl 2-[3-[4-chloranyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[3-[4-chloro-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[3-[4-chloro-5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]-1-oxopropyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-[4-chloro-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[3-[4-chloro-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C17H17ClF3N3O3S MolecularWeight: 435.84839

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)CCN2C(=C(C(=N2)C(F)(F)F)Cl)C3CC3)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)CCN2C(=C(C(=N2)C(F)(F)F)Cl)C3CC3)C(=O)OC

InChI

InChI=1S/C17H17ClF3N3O3S/c1-8-7-10(16(26)27-2)15(28-8)22-11(25)5-6-24-13(9-3-4-9)12(18)14(23-24)17(19,20)21/h7,9H,3-6H2,1-2H3,(H,22,25)