4-tert-butyl-N-[3-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-4-ium-1-yl]-3-oxo-propyl]benzamide CAS Name: 4-tert-butyl-N-[3-[4-(2-imidazo[1,2-a]pyridinylmethyl)-1-piperazin-4-iumyl]-3-oxopropyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-4-ium-1-yl]-3-oxopropyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-4-ium-1-yl]-3-keto-propyl]benzamide Formula: C26H34N5O2+ MolecularWeight: 448.58046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCC(=O)N2CC[NH+](CC2)CC3=CN4C=CC=CC4=N3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCC(=O)N2CC[NH+](CC2)CC3=CN4C=CC=CC4=N3

InChI

InChI=1S/C26H33N5O2/c1-26(2,3)21-9-7-20(8-10-21)25(33)27-12-11-24(32)30-16-14-29(15-17-30)18-22-19-31-13-5-4-6-23(31)28-22/h4-10,13,19H,11-12,14-18H2,1-3H3,(H,27,33)/p+1