N-[4,5-dimethyl-3-[(S)-(4-methylpiperazin-4-ium-1-yl)-pyridin-2-yl-methyl]thiophen-2-yl]benzamide

Systemtic Name: N-[4,5-dimethyl-3-[(S)-(4-methylpiperazin-4-ium-1-yl)-pyridin-2-yl-methyl]thiophen-2-yl]benzamide Openeye Name: N-[4,5-dimethyl-3-[(S)-(4-methylpiperazin-4-ium-1-yl)-(2-pyridyl)methyl]-2-thienyl]benzamide CAS Name: N-[4,5-dimethyl-3-[(S)-(4-methyl-1-piperazin-4-iumyl)-(2-pyridinyl)methyl]-2-thiophenyl]benzamide IUPAC Name: N-[4,5-dimethyl-3-[(S)-(4-methylpiperazin-4-ium-1-yl)-pyridin-2-ylmethyl]thiophen-2-yl]benzamide Traditional Name: N-[4,5-dimethyl-3-[(S)-(4-methylpiperazin-4-ium-1-yl)-(2-pyridyl)methyl]-2-thienyl]benzamide Formula: C24H29N4OS+ MolecularWeight: 421.57826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(C2=CC=CC=N2)N3CC[NH+](CC3)C)NC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1[C@@H](C2=CC=CC=N2)N3CC[NH+](CC3)C)NC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C24H28N4OS/c1-17-18(2)30-24(26-23(29)19-9-5-4-6-10-19)21(17)22(20-11-7-8-12-25-20)28-15-13-27(3)14-16-28/h4-12,22H,13-16H2,1-3H3,(H,26,29)/p+1/t22-/m1/s1