N3-[(2S,3R,4R,5R)-1-[3,5-bis(fluoranyl)phenyl]-6-methyl-5-(2-methylpropylcarbamoyl)-3,4-bis(oxidanyl)heptan-2-yl]-4-methyl-N1,N1-dipropyl-benzene-1,3-dicarboxamide

Systemtic Name: N3-[(2S,3R,4R,5R)-1-[3,5-bis(fluoranyl)phenyl]-6-methyl-5-(2-methylpropylcarbamoyl)-3,4-bis(oxidanyl)heptan-2-yl]-4-methyl-N1,N1-dipropyl-benzene-1,3-dicarboxamide Openeye Name: N3-[(1S,2R,3R,4R)-1-[(3,5-difluorophenyl)methyl]-2,3-dihydroxy-4-(isobutylcarbamoyl)-5-methyl-hexyl]-4-methyl-N1,N1-dipropyl-benzene-1,3-dicarboxamide CAS Name: N3-[(2S,3R,4R,5R)-1-(3,5-difluorophenyl)-3,4-dihydroxy-6-methyl-5-[(2-methylpropylamino)-oxomethyl]heptan-2-yl]-4-methyl-N1,N1-dipropylbenzene-1,3-dicarboxamide IUPAC Name: 3-N-[(2S,3R,4R,5R)-1-(3,5-difluorophenyl)-3,4-dihydroxy-6-methyl-5-(2-methylpropylcarbamoyl)heptan-2-yl]-4-methyl-1-N,1-N-dipropylbenzene-1,3-dicarboxamide Traditional Name: N'-[(1S,2R,3R,4R)-1-(3,5-difluorobenzyl)-2,3-dihydroxy-4-(isobutylcarbamoyl)-5-methyl-hexyl]-4-methyl-N,N-dipropyl-isophthalamide Formula: C34H49F2N3O5 MolecularWeight: 617.766766

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC(=C(C=C1)C)C(=O)NC(CC2=CC(=CC(=C2)F)F)C(C(C(C(C)C)C(=O)NCC(C)C)O)O

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC(=C(C=C1)C)C(=O)N[C@@H](CC2=CC(=CC(=C2)F)F)[C@H]([C@@H]([C@@H](C(C)C)C(=O)NCC(C)C)O)O

InChI

InChI=1S/C34H49F2N3O5/c1-8-12-39(13-9-2)34(44)24-11-10-22(7)27(17-24)32(42)38-28(16-23-14-25(35)18-26(36)15-23)30(40)31(41)29(21(5)6)33(43)37-19-20(3)4/h10-11,14-15,17-18,20-21,28-31,40-41H,8-9,12-13,16,19H2,1-7H3,(H,37,43)(H,38,42)/t28-,29+,30+,31+/m0/s1