1-[3-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanylmethyl]-4-methoxy-phenyl]ethanone

Systemtic Name: 1-[3-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanylmethyl]-4-methoxy-phenyl]ethanone Openeye Name: 1-[3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]-4-methoxy-phenyl]ethanone CAS Name: 1-[3-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]-4-methoxyphenyl]ethanone IUPAC Name: 1-[3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]-4-methoxyphenyl]ethanone Traditional Name: 1-[3-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]-4-methoxy-phenyl]ethanone Formula: C17H14ClNO2S2 MolecularWeight: 363.88156

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C17H14ClNO2S2/c1-10(20)11-3-5-15(21-2)12(7-11)9-22-17-19-14-8-13(18)4-6-16(14)23-17/h3-8H,9H2,1-2H3