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

Systemtic Name: 1-[3-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanylmethyl]-4-ethoxy-phenyl]ethanone Openeye Name: 1-[3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]-4-ethoxy-phenyl]ethanone CAS Name: 1-[3-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]-4-ethoxyphenyl]ethanone IUPAC Name: 1-[3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]-4-ethoxyphenyl]ethanone Traditional Name: 1-[3-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]-4-ethoxy-phenyl]ethanone Formula: C18H16ClNO2S2 MolecularWeight: 377.90814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C18H16ClNO2S2/c1-3-22-16-6-4-12(11(2)21)8-13(16)10-23-18-20-15-9-14(19)5-7-17(15)24-18/h4-9H,3,10H2,1-2H3