3-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)-N-(3-methylsulfanylphenyl)propanamide

Systemtic Name: 3-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)-N-(3-methylsulfanylphenyl)propanamide Openeye Name: 3-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)-N-(3-methylsulfanylphenyl)propanamide CAS Name: 3-[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]-N-[3-(methylthio)phenyl]propanamide IUPAC Name: 3-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)-N-(3-methylsulfanylphenyl)propanamide Traditional Name: 3-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)-N-[3-(methylthio)phenyl]propionamide Formula: C23H28N4O4S2 MolecularWeight: 488.62282

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)NC4=CC(=CC=C4)SC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)NC4=CC(=CC=C4)SC

InChI

InChI=1S/C23H28N4O4S2/c1-3-27-21-8-7-19(33(29,30)26-11-13-31-14-12-26)16-20(21)25-22(27)9-10-23(28)24-17-5-4-6-18(15-17)32-2/h4-8,15-16H,3,9-14H2,1-2H3,(H,24,28)