6-[2-methoxy-5-(oxan-4-yl)phenyl]sulfanyl-3-methyl-1,3-benzothiazol-2-one

Systemtic Name: 6-[2-methoxy-5-(oxan-4-yl)phenyl]sulfanyl-3-methyl-1,3-benzothiazol-2-one Openeye Name: 6-(2-methoxy-5-tetrahydropyran-4-yl-phenyl)sulfanyl-3-methyl-1,3-benzothiazol-2-one CAS Name: 6-[[2-methoxy-5-(4-oxanyl)phenyl]thio]-3-methyl-1,3-benzothiazol-2-one IUPAC Name: 6-[2-methoxy-5-(oxan-4-yl)phenyl]sulfanyl-3-methyl-1,3-benzothiazol-2-one Traditional Name: 6-[(2-methoxy-5-tetrahydropyran-4-yl-phenyl)thio]-3-methyl-1,3-benzothiazol-2-one Formula: C20H21NO3S2 MolecularWeight: 387.51564

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)SC3=C(C=CC(=C3)C4CCOCC4)OC)SC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)SC3=C(C=CC(=C3)C4CCOCC4)OC)SC1=O

InChI

InChI=1S/C20H21NO3S2/c1-21-16-5-4-15(12-18(16)26-20(21)22)25-19-11-14(3-6-17(19)23-2)13-7-9-24-10-8-13/h3-6,11-13H,7-10H2,1-2H3