N-(4-methylphenyl)-2-[4-(1-thiophen-2-ylcarbonylpiperidin-4-yl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[4-(1-thiophen-2-ylcarbonylpiperidin-4-yl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(p-tolyl)-2-[4-[1-(thiophene-2-carbonyl)piperidine-4-carbonyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-methylphenyl)-2-[4-[oxo-[1-[oxo(thiophen-2-yl)methyl]-4-piperidinyl]methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-methylphenyl)-2-[4-[1-(thiophene-2-carbonyl)piperidine-4-carbonyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(p-tolyl)-2-[4-[1-(2-thenoyl)isonipecotoyl]piperazin-1-ium-1-yl]acetamide Formula: C24H31N4O3S+ MolecularWeight: 455.59294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C24H30N4O3S/c1-18-4-6-20(7-5-18)25-22(29)17-26-12-14-28(15-13-26)23(30)19-8-10-27(11-9-19)24(31)21-3-2-16-32-21/h2-7,16,19H,8-15,17H2,1H3,(H,25,29)/p+1