2-[2-(3-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide

Systemtic Name: 2-[2-(3-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide Openeye Name: 2-[2-(3-chlorophenyl)-2-oxo-ethyl]sulfanyl-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide CAS Name: 2-[[2-(3-chlorophenyl)-2-oxoethyl]thio]-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide IUPAC Name: 2-[2-(3-chlorophenyl)-2-oxoethyl]sulfanyl-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-[[2-(3-chlorophenyl)-2-keto-ethyl]thio]-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide Formula: C22H17ClN2O5S2 MolecularWeight: 488.96378

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H17ClN2O5S2/c1-29-17-7-5-16(6-8-17)25-32(27,28)18-9-10-21-19(12-18)24-22(30-21)31-13-20(26)14-3-2-4-15(23)11-14/h2-12,25H,13H2,1H3