N1-[(2S,3S)-1-[3,5-bis(fluoranyl)phenyl]-3-oxidanyl-5-(3-prop-2-enoxypropanoylamino)pentan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide

Systemtic Name: N1-[(2S,3S)-1-[3,5-bis(fluoranyl)phenyl]-3-oxidanyl-5-(3-prop-2-enoxypropanoylamino)pentan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide Openeye Name: N1-[(1S,2S)-4-(3-allyloxypropanoylamino)-1-[(3,5-difluorophenyl)methyl]-2-hydroxy-butyl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide CAS Name: N1-[(2S,3S)-1-(3,5-difluorophenyl)-3-hydroxy-5-[(1-oxo-3-prop-2-enoxypropyl)amino]pentan-2-yl]-5-methyl-N3,N3-dipropylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-[(2S,3S)-1-(3,5-difluorophenyl)-3-hydroxy-5-(3-prop-2-enoxypropanoylamino)pentan-2-yl]-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide Traditional Name: N-[(1S,2S)-4-(3-allyloxypropanoylamino)-1-(3,5-difluorobenzyl)-2-hydroxy-butyl]-5-methyl-N',N'-dipropyl-isophthalamide Formula: C32H43F2N3O5 MolecularWeight: 587.697726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H43F2N3O5/c1-5-11-37(12-6-2)32(41)25-16-22(4)15-24(20-25)31(40)36-28(19-23-17-26(33)21-27(34)18-23)29(38)8-10-35-30(39)9-14-42-13-7-3/h7,15-18,20-21,28-29,38H,3,5-6,8-14,19H2,1-2,4H3,(H,35,39)(H,36,40)/t28-,29-/m0/s1