1-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]ethanone

Systemtic Name: 1-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]ethanone Openeye Name: 1-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]ethanone CAS Name: 1-[3-[(1,3-benzothiazol-2-ylthio)methyl]-4-methoxyphenyl]ethanone IUPAC Name: 1-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxyphenyl]ethanone Traditional Name: 1-[3-[(1,3-benzothiazol-2-ylthio)methyl]-4-methoxy-phenyl]ethanone Formula: C17H15NO2S2 MolecularWeight: 329.4365

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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