(diphenylmethyl) 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate

Systemtic Name: (diphenylmethyl) 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate Openeye Name: benzhydryl 2-(1,3-benzothiazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 2-(1,3-benzothiazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid benzhydryl ester Formula: C22H17NO2S2 MolecularWeight: 391.50588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H17NO2S2/c24-20(15-26-22-23-18-13-7-8-14-19(18)27-22)25-21(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-14,21H,15H2