(phenylmethyl) 2-[2-[[2-azanyl-3-(1H-imidazol-5-yl)propanoyl]amino]ethanoylamino]ethanoate

Systemtic Name: (phenylmethyl) 2-[2-[[2-azanyl-3-(1H-imidazol-5-yl)propanoyl]amino]ethanoylamino]ethanoate Openeye Name: benzyl 2-[[2-[[2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]acetyl]amino]acetate CAS Name: 2-[[2-[[2-amino-3-(1H-imidazol-5-yl)-1-oxopropyl]amino]-1-oxoethyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-[[2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]acetyl]amino]acetate Traditional Name: 2-[[2-[[2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]acetyl]amino]acetic acid benzyl ester Formula: C17H21N5O4 MolecularWeight: 359.37974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CNC(=O)CNC(=O)C(CC2=CN=CN2)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CNC(=O)CNC(=O)C(CC2=CN=CN2)N

InChI

InChI=1S/C17H21N5O4/c18-14(6-13-7-19-11-22-13)17(25)21-8-15(23)20-9-16(24)26-10-12-4-2-1-3-5-12/h1-5,7,11,14H,6,8-10,18H2,(H,19,22)(H,20,23)(H,21,25)