N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide Openeye Name: N-[2-[4-(m-tolyl)piperazin-1-ium-1-yl]ethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: N-[2-[4-(3-methylphenyl)-1-piperazin-1-iumyl]ethyl]-1-[oxo(thiophen-2-yl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-[2-[4-(m-tolyl)piperazin-1-ium-1-yl]ethyl]-1-(2-thenoyl)isonipecotamide Formula: C24H33N4O2S+ MolecularWeight: 441.60942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCNC(=O)C3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCNC(=O)C3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C24H32N4O2S/c1-19-4-2-5-21(18-19)27-15-13-26(14-16-27)12-9-25-23(29)20-7-10-28(11-8-20)24(30)22-6-3-17-31-22/h2-6,17-18,20H,7-16H2,1H3,(H,25,29)/p+1