ethyl 2-[2-[[3-[(phenylmethyl)carbamoylamino]phenyl]carbonylamino]ethanoylamino]-3-pyridin-3-yl-propanoate

Systemtic Name: ethyl 2-[2-[[3-[(phenylmethyl)carbamoylamino]phenyl]carbonylamino]ethanoylamino]-3-pyridin-3-yl-propanoate Openeye Name: ethyl 2-[[2-[[3-(benzylcarbamoylamino)benzoyl]amino]acetyl]amino]-3-(3-pyridyl)propanoate CAS Name: 2-[[1-oxo-2-[[oxo-[3-[[oxo-[(phenylmethyl)amino]methyl]amino]phenyl]methyl]amino]ethyl]amino]-3-(3-pyridinyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[[3-(benzylcarbamoylamino)benzoyl]amino]acetyl]amino]-3-pyridin-3-ylpropanoate Traditional Name: 2-[[2-[[3-(benzylcarbamoylamino)benzoyl]amino]acetyl]amino]-3-(3-pyridyl)propionic acid ethyl ester Formula: C27H29N5O5 MolecularWeight: 503.54966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CN=CC=C1)NC(=O)CNC(=O)C2=CC(=CC=C2)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(CC1=CN=CC=C1)NC(=O)CNC(=O)C2=CC(=CC=C2)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C27H29N5O5/c1-2-37-26(35)23(14-20-10-7-13-28-16-20)32-24(33)18-29-25(34)21-11-6-12-22(15-21)31-27(36)30-17-19-8-4-3-5-9-19/h3-13,15-16,23H,2,14,17-18H2,1H3,(H,29,34)(H,32,33)(H2,30,31,36)