ethyl 4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoate

Systemtic Name: ethyl 4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoate Openeye Name: ethyl 4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoate CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoate Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]benzoic acid ethyl ester Formula: C17H15NO2S2 MolecularWeight: 329.4365

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H15NO2S2/c1-2-20-16(19)13-9-7-12(8-10-13)11-21-17-18-14-5-3-4-6-15(14)22-17/h3-10H,2,11H2,1H3