N-(2-methoxyphenyl)-2-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide

Systemtic Name: N-(2-methoxyphenyl)-2-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide Openeye Name: N-(2-methoxyphenyl)-2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide CAS Name: N-(2-methoxyphenyl)-2-[[2-oxo-2-(1H-pyrrol-2-yl)ethyl]thio]-1,3-benzoxazole-5-sulfonamide IUPAC Name: N-(2-methoxyphenyl)-2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-[[2-keto-2-(1H-pyrrol-2-yl)ethyl]thio]-N-(2-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide Formula: C20H17N3O5S2 MolecularWeight: 443.49608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC(=O)C4=CC=CN4

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC(=O)C4=CC=CN4

InChI

InChI=1S/C20H17N3O5S2/c1-27-18-7-3-2-5-15(18)23-30(25,26)13-8-9-19-16(11-13)22-20(28-19)29-12-17(24)14-6-4-10-21-14/h2-11,21,23H,12H2,1H3