4-tert-butyl-N-[(2S)-1-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]amino]-1-oxidanylidene-propan-2-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[(2S)-1-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]amino]-1-oxidanylidene-propan-2-yl]benzamide Openeye Name: 4-tert-butyl-N-[(1S)-1-methyl-2-[[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]amino]-2-oxo-ethyl]benzamide CAS Name: 4-tert-butyl-N-[(2S)-1-[[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]amino]-1-oxopropan-2-yl]benzamide IUPAC Name: 4-tert-butyl-N-[(2S)-1-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]amino]-1-oxopropan-2-yl]benzamide Traditional Name: 4-tert-butyl-N-[(1S)-2-keto-1-methyl-2-[[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]amino]ethyl]benzamide Formula: C24H34N5O2+ MolecularWeight: 424.55906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CN=C(C=C1)N2CC[NH+](CC2)C)NC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)NC1=CN=C(C=C1)N2CC[NH+](CC2)C)NC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C24H33N5O2/c1-17(26-23(31)18-6-8-19(9-7-18)24(2,3)4)22(30)27-20-10-11-21(25-16-20)29-14-12-28(5)13-15-29/h6-11,16-17H,12-15H2,1-5H3,(H,26,31)(H,27,30)/p+1/t17-/m0/s1