N-[(4-fluorophenyl)methyl]-2-[3-methylbutyl(octylsulfonyl)amino]-N-[(4-oxidanylidenechromen-3-yl)methyl]ethanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-[3-methylbutyl(octylsulfonyl)amino]-N-[(4-oxidanylidenechromen-3-yl)methyl]ethanamide Openeye Name: N-[(4-fluorophenyl)methyl]-2-[isopentyl(octylsulfonyl)amino]-N-[(4-oxochromen-3-yl)methyl]acetamide CAS Name: N-[(4-fluorophenyl)methyl]-2-[3-methylbutyl(octylsulfonyl)amino]-N-[(4-oxo-1-benzopyran-3-yl)methyl]acetamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2-[3-methylbutyl(octylsulfonyl)amino]-N-[(4-oxochromen-3-yl)methyl]acetamide Traditional Name: N-(4-fluorobenzyl)-2-[isoamyl(octylsulfonyl)amino]-N-[(4-ketochromen-3-yl)methyl]acetamide Formula: C32H43FN2O5S MolecularWeight: 586.757623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)N(CCC(C)C)CC(=O)N(CC1=CC=C(C=C1)F)CC2=COC3=CC=CC=C3C2=O

Isomeric SMILES

CCCCCCCCS(=O)(=O)N(CCC(C)C)CC(=O)N(CC1=CC=C(C=C1)F)CC2=COC3=CC=CC=C3C2=O

InChI

InChI=1S/C32H43FN2O5S/c1-4-5-6-7-8-11-20-41(38,39)35(19-18-25(2)3)23-31(36)34(21-26-14-16-28(33)17-15-26)22-27-24-40-30-13-10-9-12-29(30)32(27)37/h9-10,12-17,24-25H,4-8,11,18-23H2,1-3H3