N-[2-butyl-5-methyl-3-[(2-nitrophenyl)methyl]imidazo[4,5-b]pyridin-6-yl]pentanamide

Systemtic Name: N-[2-butyl-5-methyl-3-[(2-nitrophenyl)methyl]imidazo[4,5-b]pyridin-6-yl]pentanamide Openeye Name: N-[2-butyl-5-methyl-3-[(2-nitrophenyl)methyl]imidazo[4,5-b]pyridin-6-yl]pentanamide CAS Name: N-[2-butyl-5-methyl-3-[(2-nitrophenyl)methyl]-6-imidazo[4,5-b]pyridinyl]pentanamide IUPAC Name: N-[2-butyl-5-methyl-3-[(2-nitrophenyl)methyl]imidazo[4,5-b]pyridin-6-yl]pentanamide Traditional Name: N-[2-butyl-5-methyl-3-(2-nitrobenzyl)imidazo[4,5-b]pyridin-6-yl]valeramide Formula: C23H29N5O3 MolecularWeight: 423.50806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC(=C(N=C2N1CC3=CC=CC=C3[N+](=O)[O-])C)NC(=O)CCCC

Isomeric SMILES

CCCCC1=NC2=CC(=C(N=C2N1CC3=CC=CC=C3[N+](=O)[O-])C)NC(=O)CCCC

InChI

InChI=1S/C23H29N5O3/c1-4-6-12-21-25-19-14-18(26-22(29)13-7-5-2)16(3)24-23(19)27(21)15-17-10-8-9-11-20(17)28(30)31/h8-11,14H,4-7,12-13,15H2,1-3H3,(H,26,29)