2-[2-(1H-imidazol-5-yl)ethyl-(phenethylcarbamoyl)amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[2-(1H-imidazol-5-yl)ethyl-(phenethylcarbamoyl)amino]-4-methyl-pentanoic acid Openeye Name: 2-[2-(1H-imidazol-5-yl)ethyl-(phenethylcarbamoyl)amino]-4-methyl-pentanoic acid CAS Name: 2-[2-(1H-imidazol-5-yl)ethyl-[oxo-(phenethylamino)methyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[2-(1H-imidazol-5-yl)ethyl-(phenethylcarbamoyl)amino]-4-methylpentanoic acid Traditional Name: 2-[2-(1H-imidazol-5-yl)ethyl-(phenethylcarbamoyl)amino]-4-methyl-valeric acid Formula: C20H28N4O3 MolecularWeight: 372.46132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=CN=CN1)C(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=CN=CN1)C(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C20H28N4O3/c1-15(2)12-18(19(25)26)24(11-9-17-13-21-14-23-17)20(27)22-10-8-16-6-4-3-5-7-16/h3-7,13-15,18H,8-12H2,1-2H3,(H,21,23)(H,22,27)(H,25,26)