2-[[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1-ethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1-ethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[[2-(2,3-dimethoxyphenyl)thiazol-4-yl]methylsulfanyl]-1-ethyl-benzimidazole-5-sulfonamide CAS Name: 2-[[2-(2,3-dimethoxyphenyl)-4-thiazolyl]methylthio]-1-ethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1-ethylbenzimidazole-5-sulfonamide Traditional Name: 2-[[2-(2,3-dimethoxyphenyl)thiazol-4-yl]methylthio]-1-ethyl-benzimidazole-5-sulfonamide Formula: C21H22N4O4S3 MolecularWeight: 490.61878

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CSC(=N3)C4=C(C(=CC=C4)OC)OC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CSC(=N3)C4=C(C(=CC=C4)OC)OC

InChI

InChI=1S/C21H22N4O4S3/c1-4-25-17-9-8-14(32(22,26)27)10-16(17)24-21(25)31-12-13-11-30-20(23-13)15-6-5-7-18(28-2)19(15)29-3/h5-11H,4,12H2,1-3H3,(H2,22,26,27)