N-cyclohexyl-N-phenyl-2-(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-cyclohexyl-N-phenyl-2-(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-cyclohexyl-N-phenyl-2-[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclohexyl-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazin-1-iumyl]-N-phenylacetamide IUPAC Name: N-cyclohexyl-N-phenyl-2-[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclohexyl-N-phenyl-2-[4-(2-thenoyl)piperazin-1-ium-1-yl]acetamide Formula: C23H30N3O2S+ MolecularWeight: 412.5682

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2=CC=CC=C2)C(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CCC(CC1)N(C2=CC=CC=C2)C(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C23H29N3O2S/c27-22(26(19-8-3-1-4-9-19)20-10-5-2-6-11-20)18-24-13-15-25(16-14-24)23(28)21-12-7-17-29-21/h1,3-4,7-9,12,17,20H,2,5-6,10-11,13-16,18H2/p+1