(phenylmethyl) N-[4-azanyl-1,4-bis(oxidanylidene)-1-[[3-oxidanyl-4-oxidanylidene-1-phenyl-4-[2-(pyridin-4-ylmethylcarbamoyl)pyrrolidin-1-yl]butan-2-yl]amino]butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[4-azanyl-1,4-bis(oxidanylidene)-1-[[3-oxidanyl-4-oxidanylidene-1-phenyl-4-[2-(pyridin-4-ylmethylcarbamoyl)pyrrolidin-1-yl]butan-2-yl]amino]butan-2-yl]carbamate Openeye Name: benzyl N-[3-amino-1-[[1-benzyl-2-hydroxy-3-oxo-3-[2-(4-pyridylmethylcarbamoyl)pyrrolidin-1-yl]propyl]carbamoyl]-3-oxo-propyl]carbamate CAS Name: N-[4-amino-1-[[3-hydroxy-4-oxo-4-[2-[oxo-(pyridin-4-ylmethylamino)methyl]-1-pyrrolidinyl]-1-phenylbutan-2-yl]amino]-1,4-dioxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-amino-1-[[3-hydroxy-4-oxo-1-phenyl-4-[2-(pyridin-4-ylmethylcarbamoyl)pyrrolidin-1-yl]butan-2-yl]amino]-1,4-dioxobutan-2-yl]carbamate Traditional Name: N-[3-amino-1-[[1-benzyl-2-hydroxy-3-keto-3-[2-(4-pyridylmethylcarbamoyl)pyrrolidino]propyl]carbamoyl]-3-keto-propyl]carbamic acid benzyl ester Formula: C33H38N6O7 MolecularWeight: 630.69082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(C(CC2=CC=CC=C2)NC(=O)C(CC(=O)N)NC(=O)OCC3=CC=CC=C3)O)C(=O)NCC4=CC=NC=C4

Isomeric SMILES

C1CC(N(C1)C(=O)C(C(CC2=CC=CC=C2)NC(=O)C(CC(=O)N)NC(=O)OCC3=CC=CC=C3)O)C(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C33H38N6O7/c34-28(40)19-26(38-33(45)46-21-24-10-5-2-6-11-24)30(42)37-25(18-22-8-3-1-4-9-22)29(41)32(44)39-17-7-12-27(39)31(43)36-20-23-13-15-35-16-14-23/h1-6,8-11,13-16,25-27,29,41H,7,12,17-21H2,(H2,34,40)(H,36,43)(H,37,42)(H,38,45)