(phenylmethyl) N-[1-[2-azanyl-3-(1H-imidazol-5-yl)propanoyl]pyrrolidin-2-yl]carbonyl-N-phenyl-carbamate

Systemtic Name: (phenylmethyl) N-[1-[2-azanyl-3-(1H-imidazol-5-yl)propanoyl]pyrrolidin-2-yl]carbonyl-N-phenyl-carbamate Openeye Name: benzyl N-[1-[2-amino-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carbonyl]-N-phenyl-carbamate CAS Name: N-[[1-[2-amino-3-(1H-imidazol-5-yl)-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]-N-phenylcarbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[2-amino-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carbonyl]-N-phenylcarbamate Traditional Name: N-[1-[2-amino-3-(1H-imidazol-5-yl)propanoyl]prolyl]-N-phenyl-carbamic acid benzyl ester Formula: C25H27N5O4 MolecularWeight: 461.51298

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CN=CN2)N)C(=O)N(C3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CC(N(C1)C(=O)C(CC2=CN=CN2)N)C(=O)N(C3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H27N5O4/c26-21(14-19-15-27-17-28-19)23(31)29-13-7-12-22(29)24(32)30(20-10-5-2-6-11-20)25(33)34-16-18-8-3-1-4-9-18/h1-6,8-11,15,17,21-22H,7,12-14,16,26H2,(H,27,28)