2-[(3,4-dichlorophenyl)methylsulfanyl]-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide

Systemtic Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide Openeye Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide CAS Name: 2-[(3,4-dichlorophenyl)methylthio]-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide IUPAC Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-[(3,4-dichlorobenzyl)thio]-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide Formula: C21H16Cl2N2O4S2 MolecularWeight: 495.39874

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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)SCC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H16Cl2N2O4S2/c1-28-15-5-3-14(4-6-15)25-31(26,27)16-7-9-20-19(11-16)24-21(29-20)30-12-13-2-8-17(22)18(23)10-13/h2-11,25H,12H2,1H3