(2-sulfanylidene-1,3-benzothiazol-3-yl)methyl 2-phenylsulfanylethanoate

Systemtic Name: (2-sulfanylidene-1,3-benzothiazol-3-yl)methyl 2-phenylsulfanylethanoate Openeye Name: (2-thioxo-1,3-benzothiazol-3-yl)methyl 2-phenylsulfanylacetate CAS Name: 2-(phenylthio)acetic acid (2-sulfanylidene-1,3-benzothiazol-3-yl)methyl ester IUPAC Name: (2-sulfanylidene-1,3-benzothiazol-3-yl)methyl 2-phenylsulfanylacetate Traditional Name: 2-(phenylthio)acetic acid (2-thioxo-1,3-benzothiazol-3-yl)methyl ester Formula: C16H13NO2S3 MolecularWeight: 347.47492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(=O)OCN2C3=CC=CC=C3SC2=S

Isomeric SMILES

C1=CC=C(C=C1)SCC(=O)OCN2C3=CC=CC=C3SC2=S

InChI

InChI=1S/C16H13NO2S3/c18-15(10-21-12-6-2-1-3-7-12)19-11-17-13-8-4-5-9-14(13)22-16(17)20/h1-9H,10-11H2