2-[2-[2-(4-phenylpiperazin-1-yl)ethanoylamino]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[2-(4-phenylpiperazin-1-yl)ethanoylamino]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]thiazol-4-yl]acetic acid CAS Name: 2-[2-[[1-oxo-2-(4-phenyl-1-piperazinyl)ethyl]amino]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[[2-(4-phenylpiperazino)acetyl]amino]thiazol-4-yl]acetic acid Formula: C17H20N4O3S MolecularWeight: 360.4307

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=NC(=CS2)CC(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=NC(=CS2)CC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C17H20N4O3S/c22-15(19-17-18-13(12-25-17)10-16(23)24)11-20-6-8-21(9-7-20)14-4-2-1-3-5-14/h1-5,12H,6-11H2,(H,23,24)(H,18,19,22)