4-methyl-2-[methylcarbamoyl-[2-(3-phenylazanylimidazol-4-yl)ethyl]amino]pentanoic acid

Systemtic Name: 4-methyl-2-[methylcarbamoyl-[2-(3-phenylazanylimidazol-4-yl)ethyl]amino]pentanoic acid Openeye Name: 2-[2-(3-anilinoimidazol-4-yl)ethyl-(methylcarbamoyl)amino]-4-methyl-pentanoic acid CAS Name: 2-[2-(3-anilino-4-imidazolyl)ethyl-(methylcarbamoyl)amino]-4-methylpentanoic acid IUPAC Name: 2-[2-(3-anilinoimidazol-4-yl)ethyl-(methylcarbamoyl)amino]-4-methylpentanoic acid Traditional Name: 2-[2-(3-anilinoimidazol-4-yl)ethyl-(methylcarbamoyl)amino]-4-methyl-valeric acid Formula: C19H27N5O3 MolecularWeight: 373.44938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=CN=CN1NC2=CC=CC=C2)C(=O)NC

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=CN=CN1NC2=CC=CC=C2)C(=O)NC

InChI

InChI=1S/C19H27N5O3/c1-14(2)11-17(18(25)26)23(19(27)20-3)10-9-16-12-21-13-24(16)22-15-7-5-4-6-8-15/h4-8,12-14,17,22H,9-11H2,1-3H3,(H,20,27)(H,25,26)