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

Systemtic Name: 4-[[4-(4-pyrrolidin-1-ylphenyl)-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 4-[[4-(4-pyrrolidin-1-ylphenyl)thiazol-2-yl]amino]benzoic acid CAS Name: 4-[[4-[4-(1-pyrrolidinyl)phenyl]-2-thiazolyl]amino]benzoic acid IUPAC Name: 4-[[4-(4-pyrrolidin-1-ylphenyl)-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 4-[[4-(4-pyrrolidinophenyl)thiazol-2-yl]amino]benzoic acid Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)C3=CSC(=N3)NC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)C3=CSC(=N3)NC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C20H19N3O2S/c24-19(25)15-3-7-16(8-4-15)21-20-22-18(13-26-20)14-5-9-17(10-6-14)23-11-1-2-12-23/h3-10,13H,1-2,11-12H2,(H,21,22)(H,24,25)