N-(3-cyclohexylsulfanylpropyl)-2-[(4-fluorophenyl)-thiophen-2-ylsulfonyl-amino]ethanamide

Systemtic Name: N-(3-cyclohexylsulfanylpropyl)-2-[(4-fluorophenyl)-thiophen-2-ylsulfonyl-amino]ethanamide Openeye Name: N-(3-cyclohexylsulfanylpropyl)-2-[4-fluoro-N-(2-thienylsulfonyl)anilino]acetamide CAS Name: N-[3-(cyclohexylthio)propyl]-2-(4-fluoro-N-thiophen-2-ylsulfonylanilino)acetamide IUPAC Name: N-(3-cyclohexylsulfanylpropyl)-2-(4-fluoro-N-thiophen-2-ylsulfonylanilino)acetamide Traditional Name: N-[3-(cyclohexylthio)propyl]-2-[4-fluoro-N-(2-thienylsulfonyl)anilino]acetamide Formula: C21H27FN2O3S3 MolecularWeight: 470.644083

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SCCCNC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CCC(CC1)SCCCNC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H27FN2O3S3/c22-17-9-11-18(12-10-17)24(30(26,27)21-8-4-14-29-21)16-20(25)23-13-5-15-28-19-6-2-1-3-7-19/h4,8-12,14,19H,1-3,5-7,13,15-16H2,(H,23,25)