N-(2-methoxyphenyl)-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3-benzoxazole-5-sulfonamide

Systemtic Name: N-(2-methoxyphenyl)-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3-benzoxazole-5-sulfonamide Openeye Name: N-(2-methoxyphenyl)-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3-benzoxazole-5-sulfonamide CAS Name: N-(2-methoxyphenyl)-2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-1,3-benzoxazole-5-sulfonamide IUPAC Name: N-(2-methoxyphenyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-[(2-keto-2-pyrrolidino-ethyl)thio]-N-(2-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide Formula: C20H21N3O5S2 MolecularWeight: 447.52784

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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)N4CCCC4

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC(=O)N4CCCC4

InChI

InChI=1S/C20H21N3O5S2/c1-27-17-7-3-2-6-15(17)22-30(25,26)14-8-9-18-16(12-14)21-20(28-18)29-13-19(24)23-10-4-5-11-23/h2-3,6-9,12,22H,4-5,10-11,13H2,1H3