2-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-(3-methoxypropyl)carbamoyl]benzoic acid

Systemtic Name: 2-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-(3-methoxypropyl)carbamoyl]benzoic acid Openeye Name: 2-[[4-(4-methoxyphenyl)thiazol-2-yl]-(3-methoxypropyl)carbamoyl]benzoic acid CAS Name: 2-[[[4-(4-methoxyphenyl)-2-thiazolyl]-(3-methoxypropyl)amino]-oxomethyl]benzoic acid IUPAC Name: 2-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-(3-methoxypropyl)carbamoyl]benzoic acid Traditional Name: 2-[[4-(4-methoxyphenyl)thiazol-2-yl]-(3-methoxypropyl)carbamoyl]benzoic acid Formula: C22H22N2O5S MolecularWeight: 426.48548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCN(C1=NC(=CS1)C2=CC=C(C=C2)OC)C(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

COCCCN(C1=NC(=CS1)C2=CC=C(C=C2)OC)C(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C22H22N2O5S/c1-28-13-5-12-24(20(25)17-6-3-4-7-18(17)21(26)27)22-23-19(14-30-22)15-8-10-16(29-2)11-9-15/h3-4,6-11,14H,5,12-13H2,1-2H3,(H,26,27)