N-[1-[[1-[3,5-bis(fluoranyl)phenyl]-6-(2-methylpropylamino)-3,4-bis(oxidanyl)-6-oxidanylidene-hexan-2-yl]amino]-3-heptan-4-ylsulfonyl-1-oxidanylidene-propan-2-yl]pyridine-3-carboxamide

Systemtic Name: N-[1-[[1-[3,5-bis(fluoranyl)phenyl]-6-(2-methylpropylamino)-3,4-bis(oxidanyl)-6-oxidanylidene-hexan-2-yl]amino]-3-heptan-4-ylsulfonyl-1-oxidanylidene-propan-2-yl]pyridine-3-carboxamide Openeye Name: N-[2-[[1-[(3,5-difluorophenyl)methyl]-2,3-dihydroxy-5-(isobutylamino)-5-oxo-pentyl]amino]-2-oxo-1-(1-propylbutylsulfonylmethyl)ethyl]pyridine-3-carboxamide CAS Name: N-[1-[[1-(3,5-difluorophenyl)-3,4-dihydroxy-6-(2-methylpropylamino)-6-oxohexan-2-yl]amino]-3-heptan-4-ylsulfonyl-1-oxopropan-2-yl]-3-pyridinecarboxamide IUPAC Name: N-[1-[[1-(3,5-difluorophenyl)-3,4-dihydroxy-6-(2-methylpropylamino)-6-oxohexan-2-yl]amino]-3-heptan-4-ylsulfonyl-1-oxopropan-2-yl]pyridine-3-carboxamide Traditional Name: N-[2-[[1-(3,5-difluorobenzyl)-2,3-dihydroxy-5-(isobutylamino)-5-keto-pentyl]amino]-2-keto-1-(1-propylbutylsulfonylmethyl)ethyl]nicotinamide Formula: C32H46F2N4O7S MolecularWeight: 668.792046

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)S(=O)(=O)CC(C(=O)NC(CC1=CC(=CC(=C1)F)F)C(C(CC(=O)NCC(C)C)O)O)NC(=O)C2=CN=CC=C2

Isomeric SMILES

CCCC(CCC)S(=O)(=O)CC(C(=O)NC(CC1=CC(=CC(=C1)F)F)C(C(CC(=O)NCC(C)C)O)O)NC(=O)C2=CN=CC=C2

InChI

InChI=1S/C32H46F2N4O7S/c1-5-8-25(9-6-2)46(44,45)19-27(38-31(42)22-10-7-11-35-18-22)32(43)37-26(14-21-12-23(33)15-24(34)13-21)30(41)28(39)16-29(40)36-17-20(3)4/h7,10-13,15,18,20,25-28,30,39,41H,5-6,8-9,14,16-17,19H2,1-4H3,(H,36,40)(H,37,43)(H,38,42)