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

Systemtic Name: 1-ethyl-2-[[2-[(4-methoxyphenyl)amino]-1,3-thiazol-4-yl]methylsulfanyl]benzimidazole-5-sulfonamide Openeye Name: 1-ethyl-2-[[2-(4-methoxyanilino)thiazol-4-yl]methylsulfanyl]benzimidazole-5-sulfonamide CAS Name: 1-ethyl-2-[[2-(4-methoxyanilino)-4-thiazolyl]methylthio]-5-benzimidazolesulfonamide IUPAC Name: 1-ethyl-2-[[2-(4-methoxyanilino)-1,3-thiazol-4-yl]methylsulfanyl]benzimidazole-5-sulfonamide Traditional Name: 1-ethyl-2-[[2-(p-anisidino)thiazol-4-yl]methylthio]benzimidazole-5-sulfonamide Formula: C20H21N5O3S3 MolecularWeight: 475.60744

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CSC(=N3)NC4=CC=C(C=C4)OC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CSC(=N3)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C20H21N5O3S3/c1-3-25-18-9-8-16(31(21,26)27)10-17(18)24-20(25)30-12-14-11-29-19(23-14)22-13-4-6-15(28-2)7-5-13/h4-11H,3,12H2,1-2H3,(H,22,23)(H2,21,26,27)