2-[(4-fluorophenyl)-thiophen-2-ylsulfonyl-amino]-N-[3-[(3-methylphenyl)methylsulfanyl]propyl]ethanamide

Systemtic Name: 2-[(4-fluorophenyl)-thiophen-2-ylsulfonyl-amino]-N-[3-[(3-methylphenyl)methylsulfanyl]propyl]ethanamide Openeye Name: 2-[4-fluoro-N-(2-thienylsulfonyl)anilino]-N-[3-(m-tolylmethylsulfanyl)propyl]acetamide CAS Name: 2-(4-fluoro-N-thiophen-2-ylsulfonylanilino)-N-[3-[(3-methylphenyl)methylthio]propyl]acetamide IUPAC Name: 2-(4-fluoro-N-thiophen-2-ylsulfonylanilino)-N-[3-[(3-methylphenyl)methylsulfanyl]propyl]acetamide Traditional Name: 2-[4-fluoro-N-(2-thienylsulfonyl)anilino]-N-[3-[(3-methylbenzyl)thio]propyl]acetamide Formula: C23H25FN2O3S3 MolecularWeight: 492.649603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSCCCNC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC(=CC=C1)CSCCCNC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C23H25FN2O3S3/c1-18-5-2-6-19(15-18)17-30-13-4-12-25-22(27)16-26(21-10-8-20(24)9-11-21)32(28,29)23-7-3-14-31-23/h2-3,5-11,14-15H,4,12-13,16-17H2,1H3,(H,25,27)