4-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-4-yl]benzoic acid

Systemtic Name: 4-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-4-yl]benzoic acid Openeye Name: 4-[2-(4-methylpiperazin-1-yl)thiazol-4-yl]benzoic acid CAS Name: 4-[2-(4-methyl-1-piperazinyl)-4-thiazolyl]benzoic acid IUPAC Name: 4-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-4-yl]benzoic acid Traditional Name: 4-[2-(4-methylpiperazino)thiazol-4-yl]benzoic acid Formula: C15H17N3O2S MolecularWeight: 303.37938

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=CS2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C2=NC(=CS2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C15H17N3O2S/c1-17-6-8-18(9-7-17)15-16-13(10-21-15)11-2-4-12(5-3-11)14(19)20/h2-5,10H,6-9H2,1H3,(H,19,20)