3-methyl-N-[3-(4-methylpiperazin-4-ium-1-yl)carbonyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]benzamide

Systemtic Name: 3-methyl-N-[3-(4-methylpiperazin-4-ium-1-yl)carbonyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]benzamide Openeye Name: 3-methyl-N-[3-(4-methylpiperazin-4-ium-1-carbonyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]benzamide CAS Name: 3-methyl-N-[3-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]benzamide IUPAC Name: 3-methyl-N-[3-(4-methylpiperazin-4-ium-1-carbonyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]benzamide Traditional Name: 3-methyl-N-[3-(4-methylpiperazin-4-ium-1-carbonyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]benzamide Formula: C21H26N3O2S+ MolecularWeight: 384.51504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)N4CC[NH+](CC4)C

InChI

InChI=1S/C21H25N3O2S/c1-14-5-3-6-15(13-14)19(25)22-20-18(16-7-4-8-17(16)27-20)21(26)24-11-9-23(2)10-12-24/h3,5-6,13H,4,7-12H2,1-2H3,(H,22,25)/p+1