methyl 2-[(4-fluoranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(4-fluoranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[4-fluoro-3-(1-piperidylsulfonyl)benzoyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[4-fluoro-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-fluoro-3-piperidin-1-ylsulfonylbenzoyl)amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(4-fluoro-3-piperidinosulfonyl-benzoyl)amino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C20H23FN2O5S2 MolecularWeight: 454.535423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C20H23FN2O5S2/c1-12-13(2)29-19(17(12)20(25)28-3)22-18(24)14-7-8-15(21)16(11-14)30(26,27)23-9-5-4-6-10-23/h7-8,11H,4-6,9-10H2,1-3H3,(H,22,24)