1-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(1-ethyl-2,5-dimethyl-3-pyrrolyl)-2-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]ethanone IUPAC Name: 1-(1-ethyl-2,5-dimethylpyrrol-3-yl)-2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 1-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]ethanone Formula: C23H30N4O4S2 MolecularWeight: 490.6387

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C)C(=O)CSC2=NC3=C(N2CC)C=CC(=C3)S(=O)(=O)N4CCOCC4)C

Isomeric SMILES

CCN1C(=CC(=C1C)C(=O)CSC2=NC3=C(N2CC)C=CC(=C3)S(=O)(=O)N4CCOCC4)C

InChI

InChI=1S/C23H30N4O4S2/c1-5-26-16(3)13-19(17(26)4)22(28)15-32-23-24-20-14-18(7-8-21(20)27(23)6-2)33(29,30)25-9-11-31-12-10-25/h7-8,13-14H,5-6,9-12,15H2,1-4H3