pyridin-4-ylmethyl 2-[(5-chloranyl-2-phenylmethoxy-phenyl)methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: pyridin-4-ylmethyl 2-[(5-chloranyl-2-phenylmethoxy-phenyl)methyl]-1,3-thiazole-4-carboxylate Openeye Name: 4-pyridylmethyl 2-[(2-benzyloxy-5-chloro-phenyl)methyl]thiazole-4-carboxylate CAS Name: 2-[(5-chloro-2-phenylmethoxyphenyl)methyl]-4-thiazolecarboxylic acid pyridin-4-ylmethyl ester IUPAC Name: pyridin-4-ylmethyl 2-[(5-chloro-2-phenylmethoxyphenyl)methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-(2-benzoxy-5-chloro-benzyl)thiazole-4-carboxylic acid 4-pyridylmethyl ester Formula: C24H19ClN2O3S MolecularWeight: 450.93726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)CC3=NC(=CS3)C(=O)OCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)CC3=NC(=CS3)C(=O)OCC4=CC=NC=C4

InChI

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