2-azanyl-5-(1H-imidazol-5-yl)-4-[(4-methylphenyl)carbonylamino]-2-(2-methylpropyl)-3-oxidanylidene-pentanoic acid

Systemtic Name: 2-azanyl-5-(1H-imidazol-5-yl)-4-[(4-methylphenyl)carbonylamino]-2-(2-methylpropyl)-3-oxidanylidene-pentanoic acid Openeye Name: 2-amino-5-(1H-imidazol-5-yl)-2-isobutyl-4-[(4-methylbenzoyl)amino]-3-oxo-pentanoic acid CAS Name: 2-amino-5-(1H-imidazol-5-yl)-4-[[(4-methylphenyl)-oxomethyl]amino]-2-(2-methylpropyl)-3-oxopentanoic acid IUPAC Name: 2-amino-5-(1H-imidazol-5-yl)-4-[(4-methylbenzoyl)amino]-2-(2-methylpropyl)-3-oxopentanoic acid Traditional Name: 2-amino-5-(1H-imidazol-5-yl)-2-isobutyl-3-keto-4-(p-toluoylamino)valeric acid Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(CC2=CN=CN2)C(=O)C(CC(C)C)(C(=O)O)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(CC2=CN=CN2)C(=O)C(CC(C)C)(C(=O)O)N

InChI

InChI=1S/C20H26N4O4/c1-12(2)9-20(21,19(27)28)17(25)16(8-15-10-22-11-23-15)24-18(26)14-6-4-13(3)5-7-14/h4-7,10-12,16H,8-9,21H2,1-3H3,(H,22,23)(H,24,26)(H,27,28)