(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate

Systemtic Name: (5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Openeye Name: (5-methyl-2-phenyl-oxazol-4-yl)methyl 2-(thiazol-4-ylmethylsulfanyl)benzoate CAS Name: 2-(4-thiazolylmethylthio)benzoic acid (5-methyl-2-phenyl-4-oxazolyl)methyl ester IUPAC Name: (5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Traditional Name: 2-(thiazol-4-ylmethylthio)benzoic acid (5-methyl-2-phenyl-oxazol-4-yl)methyl ester Formula: C22H18N2O3S2 MolecularWeight: 422.51992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)COC(=O)C3=CC=CC=C3SCC4=CSC=N4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)COC(=O)C3=CC=CC=C3SCC4=CSC=N4

InChI

InChI=1S/C22H18N2O3S2/c1-15-19(24-21(27-15)16-7-3-2-4-8-16)11-26-22(25)18-9-5-6-10-20(18)29-13-17-12-28-14-23-17/h2-10,12,14H,11,13H2,1H3