4-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-1-phenyl-butan-1-one

Systemtic Name: 4-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-1-phenyl-butan-1-one Openeye Name: 4-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanyl-1-phenyl-butan-1-one CAS Name: 4-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]-1-phenyl-1-butanone IUPAC Name: 4-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanyl-1-phenylbutan-1-one Traditional Name: 4-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]-1-phenyl-butan-1-one Formula: C23H27N3O4S2 MolecularWeight: 473.60818

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCCCC(=O)C4=CC=CC=C4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCCCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H27N3O4S2/c1-2-26-21-11-10-19(32(28,29)25-12-14-30-15-13-25)17-20(21)24-23(26)31-16-6-9-22(27)18-7-4-3-5-8-18/h3-5,7-8,10-11,17H,2,6,9,12-16H2,1H3