N-(4-methoxyphenyl)-2-phenacylsulfanyl-1,3-benzoxazole-5-sulfonamide

Systemtic Name: N-(4-methoxyphenyl)-2-phenacylsulfanyl-1,3-benzoxazole-5-sulfonamide Openeye Name: N-(4-methoxyphenyl)-2-phenacylsulfanyl-1,3-benzoxazole-5-sulfonamide CAS Name: N-(4-methoxyphenyl)-2-(phenacylthio)-1,3-benzoxazole-5-sulfonamide IUPAC Name: N-(4-methoxyphenyl)-2-phenacylsulfanyl-1,3-benzoxazole-5-sulfonamide Traditional Name: N-(4-methoxyphenyl)-2-(phenacylthio)-1,3-benzoxazole-5-sulfonamide Formula: C22H18N2O5S2 MolecularWeight: 454.51872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O5S2/c1-28-17-9-7-16(8-10-17)24-31(26,27)18-11-12-21-19(13-18)23-22(29-21)30-14-20(25)15-5-3-2-4-6-15/h2-13,24H,14H2,1H3