N-cyclopropyl-2-[4-(5-ethanoylthiophen-2-yl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-(5-ethanoylthiophen-2-yl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(5-acetylthiophene-2-carbonyl)piperazin-1-ium-1-yl]-N-cyclopropyl-acetamide CAS Name: 2-[4-[(5-acetyl-2-thiophenyl)-oxomethyl]-1-piperazin-1-iumyl]-N-cyclopropylacetamide IUPAC Name: 2-[4-(5-acetylthiophene-2-carbonyl)piperazin-1-ium-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[4-(5-acetylthiophene-2-carbonyl)piperazin-1-ium-1-yl]-N-cyclopropyl-acetamide Formula: C16H22N3O3S+ MolecularWeight: 336.42918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)C(=O)N2CC[NH+](CC2)CC(=O)NC3CC3

Isomeric SMILES

CC(=O)C1=CC=C(S1)C(=O)N2CC[NH+](CC2)CC(=O)NC3CC3

InChI

InChI=1S/C16H21N3O3S/c1-11(20)13-4-5-14(23-13)16(22)19-8-6-18(7-9-19)10-15(21)17-12-2-3-12/h4-5,12H,2-3,6-10H2,1H3,(H,17,21)/p+1