(2S,3R)-2-azanyl-N-[(2R)-1-[ethanoyl-[(2S)-1-[methyl-(phenylmethyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-N-methanoyl-3-oxidanyl-butanamide

Systemtic Name: (2S,3R)-2-azanyl-N-[(2R)-1-[ethanoyl-[(2S)-1-[methyl-(phenylmethyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-N-methanoyl-3-oxidanyl-butanamide Openeye Name: (2S,3R)-N-[(1R)-2-[acetyl-[(1S)-1-benzyl-2-[benzyl(methyl)amino]-2-oxo-ethyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-2-amino-N-formyl-3-hydroxy-butanamide CAS Name: (2S,3R)-N-[(2R)-1-[acetyl-[(2S)-1-[methyl-(phenylmethyl)amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-amino-N-formyl-3-hydroxybutanamide IUPAC Name: (2S,3R)-N-[(2R)-1-[acetyl-[(2S)-1-[benzyl(methyl)amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-amino-N-formyl-3-hydroxybutanamide Traditional Name: (2S,3R)-N-[(1R)-2-[acetyl-[(1S)-1-benzyl-2-[benzyl(methyl)amino]-2-keto-ethyl]amino]-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]-2-amino-N-formyl-3-hydroxy-butyramide Formula: C35H39N5O6 MolecularWeight: 625.71406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)N(C=O)C(CC1=CNC2=CC=CC=C21)C(=O)N(C(CC3=CC=CC=C3)C(=O)N(C)CC4=CC=CC=C4)C(=O)C)N)O

Isomeric SMILES

C[C@H]([C@@H](C(=O)N(C=O)[C@H](CC1=CNC2=CC=CC=C21)C(=O)N([C@@H](CC3=CC=CC=C3)C(=O)N(C)CC4=CC=CC=C4)C(=O)C)N)O

InChI

InChI=1S/C35H39N5O6/c1-23(42)32(36)35(46)39(22-41)30(19-27-20-37-29-17-11-10-16-28(27)29)34(45)40(24(2)43)31(18-25-12-6-4-7-13-25)33(44)38(3)21-26-14-8-5-9-15-26/h4-17,20,22-23,30-32,37,42H,18-19,21,36H2,1-3H3/t23-,30-,31+,32+/m1/s1