N-(2-methoxyphenyl)-2-(oxan-2-ylmethylsulfanyl)-1,3-benzoxazole-5-sulfonamide

Systemtic Name: N-(2-methoxyphenyl)-2-(oxan-2-ylmethylsulfanyl)-1,3-benzoxazole-5-sulfonamide Openeye Name: N-(2-methoxyphenyl)-2-(tetrahydropyran-2-ylmethylsulfanyl)-1,3-benzoxazole-5-sulfonamide CAS Name: N-(2-methoxyphenyl)-2-(2-oxanylmethylthio)-1,3-benzoxazole-5-sulfonamide IUPAC Name: N-(2-methoxyphenyl)-2-(oxan-2-ylmethylsulfanyl)-1,3-benzoxazole-5-sulfonamide Traditional Name: N-(2-methoxyphenyl)-2-(tetrahydropyran-2-ylmethylthio)-1,3-benzoxazole-5-sulfonamide Formula: C20H22N2O5S2 MolecularWeight: 434.52908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC4CCCCO4

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC4CCCCO4

InChI

InChI=1S/C20H22N2O5S2/c1-25-18-8-3-2-7-16(18)22-29(23,24)15-9-10-19-17(12-15)21-20(27-19)28-13-14-6-4-5-11-26-14/h2-3,7-10,12,14,22H,4-6,11,13H2,1H3