N-(3-methylbutyl)-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1H-imidazole-4-carboxamide

Systemtic Name: N-(3-methylbutyl)-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1H-imidazole-4-carboxamide Openeye Name: 5-(4-benzylpiperazine-1-carbonyl)-N-isopentyl-1H-imidazole-4-carboxamide CAS Name: N-(3-methylbutyl)-5-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-1H-imidazole-4-carboxamide IUPAC Name: 5-(4-benzylpiperazine-1-carbonyl)-N-(3-methylbutyl)-1H-imidazole-4-carboxamide Traditional Name: 5-(4-benzylpiperazine-1-carbonyl)-N-isoamyl-1H-imidazole-4-carboxamide Formula: C21H29N5O2 MolecularWeight: 383.48726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N5O2/c1-16(2)8-9-22-20(27)18-19(24-15-23-18)21(28)26-12-10-25(11-13-26)14-17-6-4-3-5-7-17/h3-7,15-16H,8-14H2,1-2H3,(H,22,27)(H,23,24)