(2S)-2-[[2-azanyl-3-(1H-imidazol-5-yl)propanoyl]amino]-3-methyl-pentanoic acid

Systemtic Name: (2S)-2-[[2-azanyl-3-(1H-imidazol-5-yl)propanoyl]amino]-3-methyl-pentanoic acid Openeye Name: (2S)-2-[[2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-methyl-pentanoic acid CAS Name: (2S)-2-[[2-amino-3-(1H-imidazol-5-yl)-1-oxopropyl]amino]-3-methylpentanoic acid IUPAC Name: (2S)-2-[[2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-methylpentanoic acid Traditional Name: (2S)-2-[[2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-methyl-valeric acid Formula: C12H20N4O3 MolecularWeight: 268.3122

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C(CC1=CN=CN1)N

Isomeric SMILES

CCC(C)[C@@H](C(=O)O)NC(=O)C(CC1=CN=CN1)N

InChI

InChI=1S/C12H20N4O3/c1-3-7(2)10(12(18)19)16-11(17)9(13)4-8-5-14-6-15-8/h5-7,9-10H,3-4,13H2,1-2H3,(H,14,15)(H,16,17)(H,18,19)/t7?,9?,10-/m0/s1