ethyl 3-[4-(4-fluorophenyl)sulfonylbutanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[4-(4-fluorophenyl)sulfonylbutanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[4-(4-fluorophenyl)sulfonylbutanoylamino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[4-(4-fluorophenyl)sulfonyl-1-oxobutyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-(4-fluorophenyl)sulfonylbutanoylamino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[4-(4-fluorophenyl)sulfonylbutanoylamino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C23H22FNO5S2 MolecularWeight: 475.552883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H22FNO5S2/c1-2-30-23(27)22-19(15-20(31-22)16-7-4-3-5-8-16)25-21(26)9-6-14-32(28,29)18-12-10-17(24)11-13-18/h3-5,7-8,10-13,15H,2,6,9,14H2,1H3,(H,25,26)