azepan-1-yl-(2-methylsulfanyl-5-morpholin-4-ylsulfonyl-phenyl)methanone

Systemtic Name: azepan-1-yl-(2-methylsulfanyl-5-morpholin-4-ylsulfonyl-phenyl)methanone Openeye Name: azepan-1-yl-(2-methylsulfanyl-5-morpholinosulfonyl-phenyl)methanone CAS Name: 1-azepanyl-[2-(methylthio)-5-(4-morpholinylsulfonyl)phenyl]methanone IUPAC Name: azepan-1-yl-(2-methylsulfanyl-5-morpholin-4-ylsulfonylphenyl)methanone Traditional Name: azepan-1-yl-[2-(methylthio)-5-morpholinosulfonyl-phenyl]methanone Formula: C18H26N2O4S2 MolecularWeight: 398.54004

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)N3CCCCCC3

Isomeric SMILES

CSC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)N3CCCCCC3

InChI

InChI=1S/C18H26N2O4S2/c1-25-17-7-6-15(26(22,23)20-10-12-24-13-11-20)14-16(17)18(21)19-8-4-2-3-5-9-19/h6-7,14H,2-5,8-13H2,1H3