4-[[4-(4-methylphenyl)-5-propyl-1,3-thiazol-2-yl]amino]benzoic acid

Systemtic Name: 4-[[4-(4-methylphenyl)-5-propyl-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 4-[[5-propyl-4-(p-tolyl)thiazol-2-yl]amino]benzoic acid CAS Name: 4-[[4-(4-methylphenyl)-5-propyl-2-thiazolyl]amino]benzoic acid IUPAC Name: 4-[[4-(4-methylphenyl)-5-propyl-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 4-[[5-propyl-4-(p-tolyl)thiazol-2-yl]amino]benzoic acid Formula: C20H20N2O2S MolecularWeight: 352.45

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=C(S1)NC2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCC1=C(N=C(S1)NC2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H20N2O2S/c1-3-4-17-18(14-7-5-13(2)6-8-14)22-20(25-17)21-16-11-9-15(10-12-16)19(23)24/h5-12H,3-4H2,1-2H3,(H,21,22)(H,23,24)