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

Systemtic Name: 2-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-(oxolan-2-ylmethyl)carbamoyl]benzoic acid Openeye Name: 2-[[4-(4-methoxyphenyl)thiazol-2-yl]-(tetrahydrofuran-2-ylmethyl)carbamoyl]benzoic acid CAS Name: 2-[[[4-(4-methoxyphenyl)-2-thiazolyl]-(2-oxolanylmethyl)amino]-oxomethyl]benzoic acid IUPAC Name: 2-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-(oxolan-2-ylmethyl)carbamoyl]benzoic acid Traditional Name: 2-[[4-(4-methoxyphenyl)thiazol-2-yl]-(tetrahydrofurfuryl)carbamoyl]benzoic acid Formula: C23H22N2O5S MolecularWeight: 438.49618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)N(CC3CCCO3)C(=O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)N(CC3CCCO3)C(=O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C23H22N2O5S/c1-29-16-10-8-15(9-11-16)20-14-31-23(24-20)25(13-17-5-4-12-30-17)21(26)18-6-2-3-7-19(18)22(27)28/h2-3,6-11,14,17H,4-5,12-13H2,1H3,(H,27,28)