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

Systemtic Name: 4-[2-[3-(dimethylamino)pyrrolidin-1-yl]-1,3-thiazol-4-yl]benzoic acid Openeye Name: 4-[2-[3-(dimethylamino)pyrrolidin-1-yl]thiazol-4-yl]benzoic acid CAS Name: 4-[2-[3-(dimethylamino)-1-pyrrolidinyl]-4-thiazolyl]benzoic acid IUPAC Name: 4-[2-[3-(dimethylamino)pyrrolidin-1-yl]-1,3-thiazol-4-yl]benzoic acid Traditional Name: 4-[2-[3-(dimethylamino)pyrrolidino]thiazol-4-yl]benzoic acid Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCN(C1)C2=NC(=CS2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CN(C)C1CCN(C1)C2=NC(=CS2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H19N3O2S/c1-18(2)13-7-8-19(9-13)16-17-14(10-22-16)11-3-5-12(6-4-11)15(20)21/h3-6,10,13H,7-9H2,1-2H3,(H,20,21)