(phenylmethyl) N-[(2S,3R)-4-[tert-butylcarbamoyl(pyridin-4-ylmethyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S,3R)-4-[tert-butylcarbamoyl(pyridin-4-ylmethyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S,2R)-1-benzyl-3-[tert-butylcarbamoyl(4-pyridylmethyl)amino]-2-hydroxy-propyl]carbamate CAS Name: N-[(2S,3R)-4-[[(tert-butylamino)-oxomethyl]-(pyridin-4-ylmethyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S,3R)-4-[tert-butylcarbamoyl(pyridin-4-ylmethyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S,2R)-1-benzyl-3-[tert-butylcarbamoyl(4-pyridylmethyl)amino]-2-hydroxy-propyl]carbamic acid benzyl ester Formula: C29H36N4O4 MolecularWeight: 504.62054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)N(CC1=CC=NC=C1)CC(C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)NC(=O)N(CC1=CC=NC=C1)C[C@H]([C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)O

InChI

InChI=1S/C29H36N4O4/c1-29(2,3)32-27(35)33(19-23-14-16-30-17-15-23)20-26(34)25(18-22-10-6-4-7-11-22)31-28(36)37-21-24-12-8-5-9-13-24/h4-17,25-26,34H,18-21H2,1-3H3,(H,31,36)(H,32,35)/t25-,26+/m0/s1