quinolin-2-ylmethyl N-[(2S)-1-[[(2S,3R)-4-[2-(tert-butylcarbamoyl)phenyl]-3-oxidanyl-1-phenyl-butan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: quinolin-2-ylmethyl N-[(2S)-1-[[(2S,3R)-4-[2-(tert-butylcarbamoyl)phenyl]-3-oxidanyl-1-phenyl-butan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: 2-quinolylmethyl N-[(1S)-1-[[(1S,2R)-1-benzyl-3-[2-(tert-butylcarbamoyl)phenyl]-2-hydroxy-propyl]carbamoyl]-2-methyl-butyl]carbamate CAS Name: N-[(2S)-1-[[(2S,3R)-4-[2-[(tert-butylamino)-oxomethyl]phenyl]-3-hydroxy-1-phenylbutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]carbamic acid 2-quinolinylmethyl ester IUPAC Name: quinolin-2-ylmethyl N-[(2S)-1-[[(2S,3R)-4-[2-(tert-butylcarbamoyl)phenyl]-3-hydroxy-1-phenylbutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S)-1-[[(1S,2R)-1-benzyl-3-[2-(tert-butylcarbamoyl)phenyl]-2-hydroxy-propyl]carbamoyl]-2-methyl-butyl]carbamic acid 2-quinolylmethyl ester Formula: C38H46N4O5 MolecularWeight: 638.79564

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC1=CC=CC=C1)C(CC2=CC=CC=C2C(=O)NC(C)(C)C)O)NC(=O)OCC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CCC(C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](CC2=CC=CC=C2C(=O)NC(C)(C)C)O)NC(=O)OCC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C38H46N4O5/c1-6-25(2)34(41-37(46)47-24-29-21-20-27-16-11-13-19-31(27)39-29)36(45)40-32(22-26-14-8-7-9-15-26)33(43)23-28-17-10-12-18-30(28)35(44)42-38(3,4)5/h7-21,25,32-34,43H,6,22-24H2,1-5H3,(H,40,45)(H,41,46)(H,42,44)/t25?,32-,33+,34-/m0/s1