3-[[4-(2-chloranyl-4-methoxy-phenyl)-5-methyl-2H-1,3-thiazol-3-yl]-propyl-amino]-4-methoxy-benzoic acid

Systemtic Name: 3-[[4-(2-chloranyl-4-methoxy-phenyl)-5-methyl-2H-1,3-thiazol-3-yl]-propyl-amino]-4-methoxy-benzoic acid Openeye Name: 3-[[4-(2-chloro-4-methoxy-phenyl)-5-methyl-2H-thiazol-3-yl]-propyl-amino]-4-methoxy-benzoic acid CAS Name: 3-[[4-(2-chloro-4-methoxyphenyl)-5-methyl-2H-thiazol-3-yl]-propylamino]-4-methoxybenzoic acid IUPAC Name: 3-[[4-(2-chloro-4-methoxyphenyl)-5-methyl-2H-1,3-thiazol-3-yl]-propylamino]-4-methoxybenzoic acid Traditional Name: 3-[[4-(2-chloro-4-methoxy-phenyl)-5-methyl-4-thiazolin-3-yl]-propyl-amino]-4-methoxy-benzoic acid Formula: C22H25ClN2O4S MolecularWeight: 448.9629

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=C(C=CC(=C1)C(=O)O)OC)N2CSC(=C2C3=C(C=C(C=C3)OC)Cl)C

Isomeric SMILES

CCCN(C1=C(C=CC(=C1)C(=O)O)OC)N2CSC(=C2C3=C(C=C(C=C3)OC)Cl)C

InChI

InChI=1S/C22H25ClN2O4S/c1-5-10-24(19-11-15(22(26)27)6-9-20(19)29-4)25-13-30-14(2)21(25)17-8-7-16(28-3)12-18(17)23/h6-9,11-12H,5,10,13H2,1-4H3,(H,26,27)