4-butyl-3-[(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-butyl-3-[(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-butyl-3-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 4-butyl-3-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]methylthio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-butyl-3-[(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-butyl-3-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methylthio]-1H-1,2,4-triazol-5-one Formula: C20H28N6O4S2 MolecularWeight: 480.60412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC2=NC3=C(N2CC)C=CC(=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC2=NC3=C(N2CC)C=CC(=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H28N6O4S2/c1-3-5-8-26-19(27)22-23-20(26)31-14-18-21-16-13-15(6-7-17(16)25(18)4-2)32(28,29)24-9-11-30-12-10-24/h6-7,13H,3-5,8-12,14H2,1-2H3,(H,22,27)