3-[1-(5-ethanoylthiophen-3-yl)carbonylpiperidin-4-yl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one

Systemtic Name: 3-[1-(5-ethanoylthiophen-3-yl)carbonylpiperidin-4-yl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Openeye Name: 3-[1-(5-acetylthiophene-3-carbonyl)-4-piperidyl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one CAS Name: 3-[1-[(5-acetyl-3-thiophenyl)-oxomethyl]-4-piperidinyl]-1-(4-ethyl-1-piperazin-4-iumyl)-1-propanone IUPAC Name: 3-[1-(5-acetylthiophene-3-carbonyl)piperidin-4-yl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Traditional Name: 3-[1-(5-acetylthiophene-3-carbonyl)-4-piperidyl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Formula: C21H32N3O3S+ MolecularWeight: 406.56208

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)CCC2CCN(CC2)C(=O)C3=CSC(=C3)C(=O)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)CCC2CCN(CC2)C(=O)C3=CSC(=C3)C(=O)C

InChI

InChI=1S/C21H31N3O3S/c1-3-22-10-12-23(13-11-22)20(26)5-4-17-6-8-24(9-7-17)21(27)18-14-19(16(2)25)28-15-18/h14-15,17H,3-13H2,1-2H3/p+1