3-[(2,4-dimethylphenyl)methyl]-5-(propanoylamino)imidazole-4-carboxamide

Systemtic Name: 3-[(2,4-dimethylphenyl)methyl]-5-(propanoylamino)imidazole-4-carboxamide Openeye Name: 3-[(2,4-dimethylphenyl)methyl]-5-(propanoylamino)imidazole-4-carboxamide CAS Name: 3-[(2,4-dimethylphenyl)methyl]-5-(1-oxopropylamino)-4-imidazolecarboxamide IUPAC Name: 3-[(2,4-dimethylphenyl)methyl]-5-(propanoylamino)imidazole-4-carboxamide Traditional Name: 3-(2,4-dimethylbenzyl)-5-propionamido-imidazole-4-carboxamide Formula: C16H20N4O2 MolecularWeight: 300.3556

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(N(C=N1)CC2=C(C=C(C=C2)C)C)C(=O)N

Isomeric SMILES

CCC(=O)NC1=C(N(C=N1)CC2=C(C=C(C=C2)C)C)C(=O)N

InChI

InChI=1S/C16H20N4O2/c1-4-13(21)19-16-14(15(17)22)20(9-18-16)8-12-6-5-10(2)7-11(12)3/h5-7,9H,4,8H2,1-3H3,(H2,17,22)(H,19,21)