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

Systemtic Name: 4-[[4-(4-methoxyphenyl)-5-propyl-1,3-thiazol-2-yl]-propanoyl-amino]benzoic acid Openeye Name: 4-[[4-(4-methoxyphenyl)-5-propyl-thiazol-2-yl]-propanoyl-amino]benzoic acid CAS Name: 4-[[4-(4-methoxyphenyl)-5-propyl-2-thiazolyl]-(1-oxopropyl)amino]benzoic acid IUPAC Name: 4-[[4-(4-methoxyphenyl)-5-propyl-1,3-thiazol-2-yl]-propanoylamino]benzoic acid Traditional Name: 4-[[4-(4-methoxyphenyl)-5-propyl-thiazol-2-yl]-propionyl-amino]benzoic acid Formula: C23H24N2O4S MolecularWeight: 424.51266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24N2O4S/c1-4-6-19-21(15-9-13-18(29-3)14-10-15)24-23(30-19)25(20(26)5-2)17-11-7-16(8-12-17)22(27)28/h7-14H,4-6H2,1-3H3,(H,27,28)