N-(2,2-dimethylpropyl)-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1H-imidazole-4-carboxamide

Systemtic Name: N-(2,2-dimethylpropyl)-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1H-imidazole-4-carboxamide Openeye Name: 5-(4-benzylpiperazine-1-carbonyl)-N-(2,2-dimethylpropyl)-1H-imidazole-4-carboxamide CAS Name: N-(2,2-dimethylpropyl)-5-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-1H-imidazole-4-carboxamide IUPAC Name: 5-(4-benzylpiperazine-1-carbonyl)-N-(2,2-dimethylpropyl)-1H-imidazole-4-carboxamide Traditional Name: 5-(4-benzylpiperazine-1-carbonyl)-N-neopentyl-1H-imidazole-4-carboxamide Formula: C21H29N5O2 MolecularWeight: 383.48726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC(=O)C1=C(NC=N1)C(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)CNC(=O)C1=C(NC=N1)C(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H29N5O2/c1-21(2,3)14-22-19(27)17-18(24-15-23-17)20(28)26-11-9-25(10-12-26)13-16-7-5-4-6-8-16/h4-8,15H,9-14H2,1-3H3,(H,22,27)(H,23,24)