2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-1-(1,2,5-trimethylpyrrol-3-yl)ethanone

Systemtic Name: 2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Openeye Name: 2-[(5-morpholinosulfonyl-2-pyridyl)sulfanyl]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone CAS Name: 2-[[5-(4-morpholinylsulfonyl)-2-pyridinyl]thio]-1-(1,2,5-trimethyl-3-pyrrolyl)ethanone IUPAC Name: 2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Traditional Name: 2-[(5-morpholinosulfonyl-2-pyridyl)thio]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Formula: C18H23N3O4S2 MolecularWeight: 409.52292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H23N3O4S2/c1-13-10-16(14(2)20(13)3)17(22)12-26-18-5-4-15(11-19-18)27(23,24)21-6-8-25-9-7-21/h4-5,10-11H,6-9,12H2,1-3H3