N-(2-chlorophenyl)-2-[(3,4-dimethoxyphenyl)amino]-1,3-benzoxazole-5-sulfonamide

Systemtic Name: N-(2-chlorophenyl)-2-[(3,4-dimethoxyphenyl)amino]-1,3-benzoxazole-5-sulfonamide Openeye Name: N-(2-chlorophenyl)-2-(3,4-dimethoxyanilino)-1,3-benzoxazole-5-sulfonamide CAS Name: N-(2-chlorophenyl)-2-(3,4-dimethoxyanilino)-1,3-benzoxazole-5-sulfonamide IUPAC Name: N-(2-chlorophenyl)-2-(3,4-dimethoxyanilino)-1,3-benzoxazole-5-sulfonamide Traditional Name: N-(2-chlorophenyl)-2-(3,4-dimethoxyanilino)-1,3-benzoxazole-5-sulfonamide Formula: C21H18ClN3O5S MolecularWeight: 459.90272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC3=C(O2)C=CC(=C3)S(=O)(=O)NC4=CC=CC=C4Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC3=C(O2)C=CC(=C3)S(=O)(=O)NC4=CC=CC=C4Cl)OC

InChI

InChI=1S/C21H18ClN3O5S/c1-28-19-9-7-13(11-20(19)29-2)23-21-24-17-12-14(8-10-18(17)30-21)31(26,27)25-16-6-4-3-5-15(16)22/h3-12,25H,1-2H3,(H,23,24)