4-tert-butyl-N-[(1S,2S)-1-(4-ethylpiperazine-1,4-diium-1-yl)-1-thiophen-2-yl-propan-2-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[(1S,2S)-1-(4-ethylpiperazine-1,4-diium-1-yl)-1-thiophen-2-yl-propan-2-yl]benzamide Openeye Name: 4-tert-butyl-N-[(1S,2S)-2-(4-ethylpiperazine-1,4-diium-1-yl)-1-methyl-2-(2-thienyl)ethyl]benzamide CAS Name: 4-tert-butyl-N-[(1S,2S)-1-(4-ethyl-1-piperazine-1,4-diiumyl)-1-thiophen-2-ylpropan-2-yl]benzamide IUPAC Name: 4-tert-butyl-N-[(1S,2S)-1-(4-ethylpiperazine-1,4-diium-1-yl)-1-thiophen-2-ylpropan-2-yl]benzamide Traditional Name: 4-tert-butyl-N-[(1S,2S)-2-(4-ethylpiperazine-1,4-diium-1-yl)-1-methyl-2-(2-thienyl)ethyl]benzamide Formula: C24H37N3OS+2 MolecularWeight: 415.63508

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)C(C2=CC=CS2)C(C)NC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)[C@H](C2=CC=CS2)[C@H](C)NC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C24H35N3OS/c1-6-26-13-15-27(16-14-26)22(21-8-7-17-29-21)18(2)25-23(28)19-9-11-20(12-10-19)24(3,4)5/h7-12,17-18,22H,6,13-16H2,1-5H3,(H,25,28)/p+2/t18-,22-/m0/s1