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

Systemtic Name: N-[4,5-dimethyl-3-[(S)-(4-methylpiperazin-4-ium-1-yl)-thiophen-2-yl-methyl]thiophen-2-yl]benzamide Openeye Name: N-[4,5-dimethyl-3-[(S)-(4-methylpiperazin-4-ium-1-yl)-(2-thienyl)methyl]-2-thienyl]benzamide CAS Name: N-[4,5-dimethyl-3-[(S)-(4-methyl-1-piperazin-4-iumyl)-thiophen-2-ylmethyl]-2-thiophenyl]benzamide IUPAC Name: N-[4,5-dimethyl-3-[(S)-(4-methylpiperazin-4-ium-1-yl)-thiophen-2-ylmethyl]thiophen-2-yl]benzamide Traditional Name: N-[4,5-dimethyl-3-[(S)-(4-methylpiperazin-4-ium-1-yl)-(2-thienyl)methyl]-2-thienyl]benzamide Formula: C23H28N3OS2+ MolecularWeight: 426.61792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(C2=CC=CS2)N3CC[NH+](CC3)C)NC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1[C@@H](C2=CC=CS2)N3CC[NH+](CC3)C)NC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C23H27N3OS2/c1-16-17(2)29-23(24-22(27)18-8-5-4-6-9-18)20(16)21(19-10-7-15-28-19)26-13-11-25(3)12-14-26/h4-10,15,21H,11-14H2,1-3H3,(H,24,27)/p+1/t21-/m1/s1