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

Systemtic Name: 3-[[3-(dimethylamino)phenyl]methyl]-5-(propanoylamino)imidazole-4-carboxamide Openeye Name: 3-[[3-(dimethylamino)phenyl]methyl]-5-(propanoylamino)imidazole-4-carboxamide CAS Name: 3-[[3-(dimethylamino)phenyl]methyl]-5-(1-oxopropylamino)-4-imidazolecarboxamide IUPAC Name: 3-[[3-(dimethylamino)phenyl]methyl]-5-(propanoylamino)imidazole-4-carboxamide Traditional Name: 3-[3-(dimethylamino)benzyl]-5-propionamido-imidazole-4-carboxamide Formula: C16H21N5O2 MolecularWeight: 315.37024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5O2/c1-4-13(22)19-16-14(15(17)23)21(10-18-16)9-11-6-5-7-12(8-11)20(2)3/h5-8,10H,4,9H2,1-3H3,(H2,17,23)(H,19,22)