methyl (2S)-2-[2-(2-indazol-1-ylethanoylamino)ethanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[2-(2-indazol-1-ylethanoylamino)ethanoylamino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[[2-[(2-indazol-1-ylacetyl)amino]acetyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[2-[[2-(1-indazolyl)-1-oxoethyl]amino]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-[(2-indazol-1-ylacetyl)amino]acetyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[2-[(2-indazol-1-ylacetyl)amino]acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C18H24N4O4 MolecularWeight: 360.40756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CNC(=O)CN1C2=CC=CC=C2C=N1

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC)NC(=O)CNC(=O)CN1C2=CC=CC=C2C=N1

InChI

InChI=1S/C18H24N4O4/c1-12(2)8-14(18(25)26-3)21-16(23)10-19-17(24)11-22-15-7-5-4-6-13(15)9-20-22/h4-7,9,12,14H,8,10-11H2,1-3H3,(H,19,24)(H,21,23)/t14-/m0/s1