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

Systemtic Name: methyl (2S)-2-[2-(2-indazol-2-ylethanoylamino)ethanoylamino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[[2-[(2-indazol-2-ylacetyl)amino]acetyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[2-[[2-(2-indazolyl)-1-oxoethyl]amino]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-[(2-indazol-2-ylacetyl)amino]acetyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[2-[(2-indazol-2-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)CN1C=C2C=CC=CC2=N1

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC)NC(=O)CNC(=O)CN1C=C2C=CC=CC2=N1

InChI

InChI=1S/C18H24N4O4/c1-12(2)8-15(18(25)26-3)20-16(23)9-19-17(24)11-22-10-13-6-4-5-7-14(13)21-22/h4-7,10,12,15H,8-9,11H2,1-3H3,(H,19,24)(H,20,23)/t15-/m0/s1