methyl (2S)-2-[2-(2-indazol-1-ylethanoylamino)ethanoylamino]-2-phenyl-ethanoate

Systemtic Name: methyl (2S)-2-[2-(2-indazol-1-ylethanoylamino)ethanoylamino]-2-phenyl-ethanoate Openeye Name: methyl (2S)-2-[[2-[(2-indazol-1-ylacetyl)amino]acetyl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[2-[[2-(1-indazolyl)-1-oxoethyl]amino]-1-oxoethyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-[(2-indazol-1-ylacetyl)amino]acetyl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[2-[(2-indazol-1-ylacetyl)amino]acetyl]amino]-2-phenyl-acetic acid methyl ester Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)NC(=O)CNC(=O)CN2C3=CC=CC=C3C=N2

Isomeric SMILES

COC(=O)[C@H](C1=CC=CC=C1)NC(=O)CNC(=O)CN2C3=CC=CC=C3C=N2

InChI

InChI=1S/C20H20N4O4/c1-28-20(27)19(14-7-3-2-4-8-14)23-17(25)12-21-18(26)13-24-16-10-6-5-9-15(16)11-22-24/h2-11,19H,12-13H2,1H3,(H,21,26)(H,23,25)/t19-/m0/s1