3-[(4-phenylmethoxyphenyl)methyl]-5-(propanoylamino)imidazole-4-carboxamide

Systemtic Name: 3-[(4-phenylmethoxyphenyl)methyl]-5-(propanoylamino)imidazole-4-carboxamide Openeye Name: 3-[(4-benzyloxyphenyl)methyl]-5-(propanoylamino)imidazole-4-carboxamide CAS Name: 5-(1-oxopropylamino)-3-[(4-phenylmethoxyphenyl)methyl]-4-imidazolecarboxamide IUPAC Name: 3-[(4-phenylmethoxyphenyl)methyl]-5-(propanoylamino)imidazole-4-carboxamide Traditional Name: 3-(4-benzoxybenzyl)-5-propionamido-imidazole-4-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(N(C=N1)CC2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)N

Isomeric SMILES

CCC(=O)NC1=C(N(C=N1)CC2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C21H22N4O3/c1-2-18(26)24-21-19(20(22)27)25(14-23-21)12-15-8-10-17(11-9-15)28-13-16-6-4-3-5-7-16/h3-11,14H,2,12-13H2,1H3,(H2,22,27)(H,24,26)