2-(4-ethanoylpiperazin-1-yl)-5-(thiophen-2-ylcarbonylamino)benzoic acid

Systemtic Name: 2-(4-ethanoylpiperazin-1-yl)-5-(thiophen-2-ylcarbonylamino)benzoic acid Openeye Name: 2-(4-acetylpiperazin-1-yl)-5-(thiophene-2-carbonylamino)benzoic acid CAS Name: 2-(4-acetyl-1-piperazinyl)-5-[[oxo(thiophen-2-yl)methyl]amino]benzoic acid IUPAC Name: 2-(4-acetylpiperazin-1-yl)-5-(thiophene-2-carbonylamino)benzoic acid Traditional Name: 2-(4-acetylpiperazino)-5-(2-thenoylamino)benzoic acid Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=CS3)C(=O)O

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=CS3)C(=O)O

InChI

InChI=1S/C18H19N3O4S/c1-12(22)20-6-8-21(9-7-20)15-5-4-13(11-14(15)18(24)25)19-17(23)16-3-2-10-26-16/h2-5,10-11H,6-9H2,1H3,(H,19,23)(H,24,25)