ethyl (2S)-2-[[(2S)-1-oxidanylidene-3-phenyl-1-(pyridin-4-ylamino)propan-2-yl]carbamoylamino]-3-phenyl-propanoate

Systemtic Name: ethyl (2S)-2-[[(2S)-1-oxidanylidene-3-phenyl-1-(pyridin-4-ylamino)propan-2-yl]carbamoylamino]-3-phenyl-propanoate Openeye Name: ethyl (2S)-2-[[(1S)-1-benzyl-2-oxo-2-(4-pyridylamino)ethyl]carbamoylamino]-3-phenyl-propanoate CAS Name: (2S)-2-[[oxo-[[(2S)-1-oxo-3-phenyl-1-(pyridin-4-ylamino)propan-2-yl]amino]methyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[(2S)-1-oxo-3-phenyl-1-(pyridin-4-ylamino)propan-2-yl]carbamoylamino]-3-phenylpropanoate Traditional Name: (2S)-2-[[(1S)-1-benzyl-2-keto-2-(4-pyridylamino)ethyl]carbamoylamino]-3-phenyl-propionic acid ethyl ester Formula: C26H28N4O4 MolecularWeight: 460.52492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)NC(CC2=CC=CC=C2)C(=O)NC3=CC=NC=C3

Isomeric SMILES

CCOC(=O)[C@H](CC1=CC=CC=C1)NC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NC3=CC=NC=C3

InChI

InChI=1S/C26H28N4O4/c1-2-34-25(32)23(18-20-11-7-4-8-12-20)30-26(33)29-22(17-19-9-5-3-6-10-19)24(31)28-21-13-15-27-16-14-21/h3-16,22-23H,2,17-18H2,1H3,(H,27,28,31)(H2,29,30,33)/t22-,23-/m0/s1