(phenylmethyl) N-[(2S)-4-azanyl-1-[[(2S,3R)-4-[(2S)-2-[[(2S)-3-methyl-1-(2-methylpropylamino)-1-oxidanylidene-pentan-2-yl]carbamoyl]pyrrolidin-1-yl]-3-oxidanyl-1-phenyl-butan-2-yl]amino]-1,4-bis(oxidanylidene)butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-4-azanyl-1-[[(2S,3R)-4-[(2S)-2-[[(2S)-3-methyl-1-(2-methylpropylamino)-1-oxidanylidene-pentan-2-yl]carbamoyl]pyrrolidin-1-yl]-3-oxidanyl-1-phenyl-butan-2-yl]amino]-1,4-bis(oxidanylidene)butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-3-amino-1-[[(1S,2R)-1-benzyl-2-hydroxy-3-[(2S)-2-[[(1S)-1-(isobutylcarbamoyl)-2-methyl-butyl]carbamoyl]pyrrolidin-1-yl]propyl]carbamoyl]-3-oxo-propyl]carbamate CAS Name: N-[(2S)-4-amino-1-[[(2S,3R)-3-hydroxy-4-[(2S)-2-[[[(2S)-3-methyl-1-(2-methylpropylamino)-1-oxopentan-2-yl]amino]-oxomethyl]-1-pyrrolidinyl]-1-phenylbutan-2-yl]amino]-1,4-dioxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-4-amino-1-[[(2S,3R)-3-hydroxy-4-[(2S)-2-[[(2S)-3-methyl-1-(2-methylpropylamino)-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-phenylbutan-2-yl]amino]-1,4-dioxobutan-2-yl]carbamate Traditional Name: N-[(1S)-3-amino-1-[[(1S,2R)-1-benzyl-2-hydroxy-3-[(2S)-2-[[(1S)-1-(isobutylcarbamoyl)-2-methyl-butyl]carbamoyl]pyrrolidino]propyl]carbamoyl]-3-keto-propyl]carbamic acid benzyl ester Formula: C37H54N6O7 MolecularWeight: 694.86066

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCC(C)C)NC(=O)C1CCCN1CC(C(CC2=CC=CC=C2)NC(=O)C(CC(=O)N)NC(=O)OCC3=CC=CC=C3)O

Isomeric SMILES

CCC(C)[C@@H](C(=O)NCC(C)C)NC(=O)[C@@H]1CCCN1C[C@H]([C@H](CC2=CC=CC=C2)NC(=O)[C@H](CC(=O)N)NC(=O)OCC3=CC=CC=C3)O

InChI

InChI=1S/C37H54N6O7/c1-5-25(4)33(36(48)39-21-24(2)3)42-35(47)30-17-12-18-43(30)22-31(44)28(19-26-13-8-6-9-14-26)40-34(46)29(20-32(38)45)41-37(49)50-23-27-15-10-7-11-16-27/h6-11,13-16,24-25,28-31,33,44H,5,12,17-23H2,1-4H3,(H2,38,45)(H,39,48)(H,40,46)(H,41,49)(H,42,47)/t25?,28-,29-,30-,31+,33-/m0/s1