methyl 2-[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoylamino]-5-propyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoylamino]-5-propyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(2-chloro-6-fluoro-phenyl)acetyl]amino]-5-propyl-thiophene-3-carboxylate CAS Name: 2-[[2-(2-chloro-6-fluorophenyl)-1-oxoethyl]amino]-5-propyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]-5-propylthiophene-3-carboxylate Traditional Name: 2-[[2-(2-chloro-6-fluoro-phenyl)acetyl]amino]-5-propyl-thiophene-3-carboxylic acid methyl ester Formula: C17H17ClFNO3S MolecularWeight: 369.838183

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(S1)NC(=O)CC2=C(C=CC=C2Cl)F)C(=O)OC

Isomeric SMILES

CCCC1=CC(=C(S1)NC(=O)CC2=C(C=CC=C2Cl)F)C(=O)OC

InChI

InChI=1S/C17H17ClFNO3S/c1-3-5-10-8-12(17(22)23-2)16(24-10)20-15(21)9-11-13(18)6-4-7-14(11)19/h4,6-8H,3,5,9H2,1-2H3,(H,20,21)