N-[4-[(2-fluoranyl-5-methylsulfonyl-phenyl)amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-[(2-fluoranyl-5-methylsulfonyl-phenyl)amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-(2-fluoro-5-methylsulfonyl-anilino)-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-(2-fluoro-5-methylsulfonylanilino)-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-(2-fluoro-5-methylsulfonylanilino)-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-(2-fluoro-5-mesyl-anilino)-4-keto-butyl]thiophene-3-carboxamide Formula: C16H17FN2O4S2 MolecularWeight: 384.445583

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)F)NC(=O)CCCNC(=O)C2=CSC=C2

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)F)NC(=O)CCCNC(=O)C2=CSC=C2

InChI

InChI=1S/C16H17FN2O4S2/c1-25(22,23)12-4-5-13(17)14(9-12)19-15(20)3-2-7-18-16(21)11-6-8-24-10-11/h4-6,8-10H,2-3,7H2,1H3,(H,18,21)(H,19,20)