2-[(5-methoxy-1,3-benzothiazol-2-yl)sulfinyl]-1-phenyl-ethanone

Systemtic Name: 2-[(5-methoxy-1,3-benzothiazol-2-yl)sulfinyl]-1-phenyl-ethanone Openeye Name: 2-[(5-methoxy-1,3-benzothiazol-2-yl)sulfinyl]-1-phenyl-ethanone CAS Name: 2-[(5-methoxy-1,3-benzothiazol-2-yl)sulfinyl]-1-phenylethanone IUPAC Name: 2-[(5-methoxy-1,3-benzothiazol-2-yl)sulfinyl]-1-phenylethanone Traditional Name: 2-[(5-methoxy-1,3-benzothiazol-2-yl)sulfinyl]-1-phenyl-ethanone Formula: C16H13NO3S2 MolecularWeight: 331.40932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=N2)S(=O)CC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=N2)S(=O)CC(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H13NO3S2/c1-20-12-7-8-15-13(9-12)17-16(21-15)22(19)10-14(18)11-5-3-2-4-6-11/h2-9H,10H2,1H3