methyl (2R,3S)-3-methyl-2-[2-(2-methylbenzimidazol-1-yl)ethanoylamino]pentanoate

Systemtic Name: methyl (2R,3S)-3-methyl-2-[2-(2-methylbenzimidazol-1-yl)ethanoylamino]pentanoate Openeye Name: methyl (2R,3S)-3-methyl-2-[[2-(2-methylbenzimidazol-1-yl)acetyl]amino]pentanoate CAS Name: (2R,3S)-3-methyl-2-[[2-(2-methyl-1-benzimidazolyl)-1-oxoethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2R,3S)-3-methyl-2-[[2-(2-methylbenzimidazol-1-yl)acetyl]amino]pentanoate Traditional Name: (2R,3S)-3-methyl-2-[[2-(2-methylbenzimidazol-1-yl)acetyl]amino]valeric acid methyl ester Formula: C17H23N3O3 MolecularWeight: 317.38282

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)CN1C(=NC2=CC=CC=C21)C

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)OC)NC(=O)CN1C(=NC2=CC=CC=C21)C

InChI

InChI=1S/C17H23N3O3/c1-5-11(2)16(17(22)23-4)19-15(21)10-20-12(3)18-13-8-6-7-9-14(13)20/h6-9,11,16H,5,10H2,1-4H3,(H,19,21)/t11-,16+/m0/s1