2-(4-methylsulfonyl-1,4-diazepan-1-yl)-1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethanone

Systemtic Name: 2-(4-methylsulfonyl-1,4-diazepan-1-yl)-1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethanone Openeye Name: 2-(4-methylsulfonyl-1,4-diazepan-1-yl)-1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethanone CAS Name: 2-(4-methylsulfonyl-1,4-diazepan-1-yl)-1-[6-(1-pyrrolidinylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]ethanone IUPAC Name: 2-(4-methylsulfonyl-1,4-diazepan-1-yl)-1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethanone Traditional Name: 2-(4-mesyl-1,4-diazepan-1-yl)-1-(6-pyrrolidinosulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethanone Formula: C21H32N4O5S2 MolecularWeight: 484.63258

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(CC1)CC(=O)N2CCCC3=C2C=CC(=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CS(=O)(=O)N1CCCN(CC1)CC(=O)N2CCCC3=C2C=CC(=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H32N4O5S2/c1-31(27,28)23-12-5-9-22(14-15-23)17-21(26)25-13-4-6-18-16-19(7-8-20(18)25)32(29,30)24-10-2-3-11-24/h7-8,16H,2-6,9-15,17H2,1H3