1,3-benzothiazol-2-ylmethyl 2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]ethanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-[(2-phenyloxazol-4-yl)methylsulfanyl]acetate CAS Name: 2-[(2-phenyl-4-oxazolyl)methylthio]acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]acetate Traditional Name: 2-[(2-phenyloxazol-4-yl)methylthio]acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C20H16N2O3S2 MolecularWeight: 396.48264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CO2)CSCC(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CO2)CSCC(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H16N2O3S2/c23-19(24-11-18-22-16-8-4-5-9-17(16)27-18)13-26-12-15-10-25-20(21-15)14-6-2-1-3-7-14/h1-10H,11-13H2