4-[[4-[4-(propanoylamino)phenyl]-1,3-thiazol-2-yl]amino]benzoic acid

Systemtic Name: 4-[[4-[4-(propanoylamino)phenyl]-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 4-[[4-[4-(propanoylamino)phenyl]thiazol-2-yl]amino]benzoic acid CAS Name: 4-[[4-[4-(1-oxopropylamino)phenyl]-2-thiazolyl]amino]benzoic acid IUPAC Name: 4-[[4-[4-(propanoylamino)phenyl]-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 4-[[4-(4-propionamidophenyl)thiazol-2-yl]amino]benzoic acid Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H17N3O3S/c1-2-17(23)20-14-7-3-12(4-8-14)16-11-26-19(22-16)21-15-9-5-13(6-10-15)18(24)25/h3-11H,2H2,1H3,(H,20,23)(H,21,22)(H,24,25)