(3R,4S,5S)-5-(hydroxymethyl)-N-[3-[methyl(phenyl)amino]propyl]-4-[(1R)-1-oxidanylethyl]-2-[[3-[3-[(phenylmethyl)carbamoylamino]prop-1-ynyl]phenyl]methyl]-1,2-oxazolidine-3-carboxamide

Systemtic Name: (3R,4S,5S)-5-(hydroxymethyl)-N-[3-[methyl(phenyl)amino]propyl]-4-[(1R)-1-oxidanylethyl]-2-[[3-[3-[(phenylmethyl)carbamoylamino]prop-1-ynyl]phenyl]methyl]-1,2-oxazolidine-3-carboxamide Openeye Name: (3R,4S,5S)-2-[[3-[3-(benzylcarbamoylamino)prop-1-ynyl]phenyl]methyl]-4-[(1R)-1-hydroxyethyl]-5-(hydroxymethyl)-N-[3-(N-methylanilino)propyl]isoxazolidine-3-carboxamide CAS Name: (3R,4S,5S)-4-[(1R)-1-hydroxyethyl]-5-(hydroxymethyl)-N-[3-(N-methylanilino)propyl]-2-[[3-[3-[[oxo-[(phenylmethyl)amino]methyl]amino]prop-1-ynyl]phenyl]methyl]-3-isoxazolidinecarboxamide IUPAC Name: (3R,4S,5S)-2-[[3-[3-(benzylcarbamoylamino)prop-1-ynyl]phenyl]methyl]-4-[(1R)-1-hydroxyethyl]-5-(hydroxymethyl)-N-[3-(N-methylanilino)propyl]-1,2-oxazolidine-3-carboxamide Traditional Name: (3R,4S,5S)-2-[3-[3-(benzylcarbamoylamino)prop-1-ynyl]benzyl]-4-[(1R)-1-hydroxyethyl]-N-[3-(N-methylanilino)propyl]-5-methylol-isoxazolidine-3-carboxamide Formula: C35H43N5O5 MolecularWeight: 613.74642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(ON(C1C(=O)NCCCN(C)C2=CC=CC=C2)CC3=CC=CC(=C3)C#CCNC(=O)NCC4=CC=CC=C4)CO)O

Isomeric SMILES

C[C@H]([C@H]1[C@H](ON([C@H]1C(=O)NCCCN(C)C2=CC=CC=C2)CC3=CC=CC(=C3)C#CCNC(=O)NCC4=CC=CC=C4)CO)O

InChI

InChI=1S/C35H43N5O5/c1-26(42)32-31(25-41)45-40(33(32)34(43)36-20-11-21-39(2)30-17-7-4-8-18-30)24-29-15-9-14-27(22-29)16-10-19-37-35(44)38-23-28-12-5-3-6-13-28/h3-9,12-15,17-18,22,26,31-33,41-42H,11,19-21,23-25H2,1-2H3,(H,36,43)(H2,37,38,44)/t26-,31-,32+,33-/m1/s1