2-(2-methylpropylsulfonylmethyl)-4-morpholin-4-yl-4-oxidanylidene-N-[3-oxidanylidene-1-(phenylsulfonyl)azepan-4-yl]butanamide

Systemtic Name: 2-(2-methylpropylsulfonylmethyl)-4-morpholin-4-yl-4-oxidanylidene-N-[3-oxidanylidene-1-(phenylsulfonyl)azepan-4-yl]butanamide Openeye Name: N-[1-(benzenesulfonyl)-3-oxo-azepan-4-yl]-2-(isobutylsulfonylmethyl)-4-morpholino-4-oxo-butanamide CAS Name: N-[1-(benzenesulfonyl)-3-oxo-4-azepanyl]-2-(2-methylpropylsulfonylmethyl)-4-(4-morpholinyl)-4-oxobutanamide IUPAC Name: N-[1-(benzenesulfonyl)-3-oxoazepan-4-yl]-2-(2-methylpropylsulfonylmethyl)-4-morpholin-4-yl-4-oxobutanamide Traditional Name: N-(1-besyl-3-keto-azepan-4-yl)-2-(isobutylsulfonylmethyl)-4-keto-4-morpholino-butyramide Formula: C25H37N3O8S2 MolecularWeight: 571.70658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CS(=O)(=O)CC(CC(=O)N1CCOCC1)C(=O)NC2CCCN(CC2=O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)CS(=O)(=O)CC(CC(=O)N1CCOCC1)C(=O)NC2CCCN(CC2=O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H37N3O8S2/c1-19(2)17-37(32,33)18-20(15-24(30)27-11-13-36-14-12-27)25(31)26-22-9-6-10-28(16-23(22)29)38(34,35)21-7-4-3-5-8-21/h3-5,7-8,19-20,22H,6,9-18H2,1-2H3,(H,26,31)