4-[2-[(4-tert-butylphenyl)methylsulfanyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine

Systemtic Name: 4-[2-[(4-tert-butylphenyl)methylsulfanyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[2-[(4-tert-butylphenyl)methylsulfanyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[2-[(4-tert-butylphenyl)methylthio]-1-ethyl-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[2-[(4-tert-butylphenyl)methylsulfanyl]-1-ethylbenzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[2-[(4-tert-butylbenzyl)thio]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine Formula: C24H31N3O3S2 MolecularWeight: 473.65124

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C24H31N3O3S2/c1-5-27-22-11-10-20(32(28,29)26-12-14-30-15-13-26)16-21(22)25-23(27)31-17-18-6-8-19(9-7-18)24(2,3)4/h6-11,16H,5,12-15,17H2,1-4H3