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

Systemtic Name: 4-[[[4-(5-chloranyl-2-phenylmethoxy-phenyl)-1,3-thiazol-2-yl]amino]methyl]benzoic acid Openeye Name: 4-[[[4-(2-benzyloxy-5-chloro-phenyl)thiazol-2-yl]amino]methyl]benzoic acid CAS Name: 4-[[[4-(5-chloro-2-phenylmethoxyphenyl)-2-thiazolyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[4-(5-chloro-2-phenylmethoxyphenyl)-1,3-thiazol-2-yl]amino]methyl]benzoic acid Traditional Name: 4-[[[4-(2-benzoxy-5-chloro-phenyl)thiazol-2-yl]amino]methyl]benzoic acid Formula: C24H19ClN2O3S MolecularWeight: 450.93726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C3=CSC(=N3)NCC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C3=CSC(=N3)NCC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H19ClN2O3S/c25-19-10-11-22(30-14-17-4-2-1-3-5-17)20(12-19)21-15-31-24(27-21)26-13-16-6-8-18(9-7-16)23(28)29/h1-12,15H,13-14H2,(H,26,27)(H,28,29)