2-acetamido-3-(1H-imidazol-5-yl)-N-[1-(2-methylbutan-2-ylamino)-1-oxidanylidene-propan-2-yl]-N-(phenylmethyl)propanamide

Systemtic Name: 2-acetamido-3-(1H-imidazol-5-yl)-N-[1-(2-methylbutan-2-ylamino)-1-oxidanylidene-propan-2-yl]-N-(phenylmethyl)propanamide Openeye Name: 2-acetamido-N-benzyl-N-[2-(1,1-dimethylpropylamino)-1-methyl-2-oxo-ethyl]-3-(1H-imidazol-5-yl)propanamide CAS Name: 2-acetamido-3-(1H-imidazol-5-yl)-N-[1-(2-methylbutan-2-ylamino)-1-oxopropan-2-yl]-N-(phenylmethyl)propanamide IUPAC Name: 2-acetamido-N-benzyl-3-(1H-imidazol-5-yl)-N-[1-(2-methylbutan-2-ylamino)-1-oxopropan-2-yl]propanamide Traditional Name: 2-acetamido-N-[2-(tert-amylamino)-2-keto-1-methyl-ethyl]-N-benzyl-3-(1H-imidazol-5-yl)propionamide Formula: C23H33N5O3 MolecularWeight: 427.53982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H33N5O3/c1-6-23(4,5)27-21(30)16(2)28(14-18-10-8-7-9-11-18)22(31)20(26-17(3)29)12-19-13-24-15-25-19/h7-11,13,15-16,20H,6,12,14H2,1-5H3,(H,24,25)(H,26,29)(H,27,30)