(phenylmethyl) (2S)-2-[[5-(5-azanylpentylcarbamoyl)-1H-imidazol-4-yl]carbonylamino]-4-methyl-pentanoate

Systemtic Name: (phenylmethyl) (2S)-2-[[5-(5-azanylpentylcarbamoyl)-1H-imidazol-4-yl]carbonylamino]-4-methyl-pentanoate Openeye Name: benzyl (2S)-2-[[5-(5-aminopentylcarbamoyl)-1H-imidazole-4-carbonyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[[5-[(5-aminopentylamino)-oxomethyl]-1H-imidazol-4-yl]-oxomethyl]amino]-4-methylpentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[5-(5-aminopentylcarbamoyl)-1H-imidazole-4-carbonyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[5-(5-aminopentylcarbamoyl)-1H-imidazole-4-carbonyl]amino]-4-methyl-valeric acid benzyl ester Formula: C23H33N5O4 MolecularWeight: 443.53922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=CC=CC=C1)NC(=O)C2=C(NC=N2)C(=O)NCCCCCN

Isomeric SMILES

CC(C)C[C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)C2=C(NC=N2)C(=O)NCCCCCN

InChI

InChI=1S/C23H33N5O4/c1-16(2)13-18(23(31)32-14-17-9-5-3-6-10-17)28-22(30)20-19(26-15-27-20)21(29)25-12-8-4-7-11-24/h3,5-6,9-10,15-16,18H,4,7-8,11-14,24H2,1-2H3,(H,25,29)(H,26,27)(H,28,30)/t18-/m0/s1