N-cyclopentyl-2-[2-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: N-cyclopentyl-2-[2-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: N-cyclopentyl-2-[[2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-cyclopentyl-2-[[2-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopentyl-2-[[2-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: N-cyclopentyl-2-[[2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C26H37N6O2+ MolecularWeight: 465.61098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3C(=O)NC4CCCC4

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3C(=O)NC4CCCC4

InChI

InChI=1S/C26H36N6O2/c1-18(2)25-27-19(3)16-23(30-25)32-14-12-31(13-15-32)17-24(33)29-22-11-7-6-10-21(22)26(34)28-20-8-4-5-9-20/h6-7,10-11,16,18,20H,4-5,8-9,12-15,17H2,1-3H3,(H,28,34)(H,29,33)/p+1