2-[(6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-1-ethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[(6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-1-ethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(6-chloro-7-ethyl-2-oxo-chromen-4-yl)methylsulfanyl]-1-ethyl-benzimidazole-5-sulfonamide CAS Name: 2-[(6-chloro-7-ethyl-2-oxo-1-benzopyran-4-yl)methylthio]-1-ethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(6-chloro-7-ethyl-2-oxochromen-4-yl)methylsulfanyl]-1-ethylbenzimidazole-5-sulfonamide Traditional Name: 2-[(6-chloro-7-ethyl-2-keto-chromen-4-yl)methylthio]-1-ethyl-benzimidazole-5-sulfonamide Formula: C21H20ClN3O4S2 MolecularWeight: 477.9842

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC4=C(N3CC)C=CC(=C4)S(=O)(=O)N)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC4=C(N3CC)C=CC(=C4)S(=O)(=O)N)Cl

InChI

InChI=1S/C21H20ClN3O4S2/c1-3-12-7-19-15(10-16(12)22)13(8-20(26)29-19)11-30-21-24-17-9-14(31(23,27)28)5-6-18(17)25(21)4-2/h5-10H,3-4,11H2,1-2H3,(H2,23,27,28)