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

Systemtic Name: 4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-1,3-thiazol-4-yl]benzoic acid Openeye Name: 4-[2-[4-(2-methoxyethyl)piperazin-1-yl]thiazol-4-yl]benzoic acid CAS Name: 4-[2-[4-(2-methoxyethyl)-1-piperazinyl]-4-thiazolyl]benzoic acid IUPAC Name: 4-[2-[4-(2-methoxyethyl)piperazin-1-yl]-1,3-thiazol-4-yl]benzoic acid Traditional Name: 4-[2-[4-(2-methoxyethyl)piperazino]thiazol-4-yl]benzoic acid Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1CCN(CC1)C2=NC(=CS2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COCCN1CCN(CC1)C2=NC(=CS2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C17H21N3O3S/c1-23-11-10-19-6-8-20(9-7-19)17-18-15(12-24-17)13-2-4-14(5-3-13)16(21)22/h2-5,12H,6-11H2,1H3,(H,21,22)