2-methyl-4-morpholin-4-yl-4-oxidanylidene-N-[1-oxidanyl-1-(2-phenyl-1,3-dithian-2-yl)hexan-2-yl]-2-(phenylmethyl)sulfonyl-butanamide

Systemtic Name: 2-methyl-4-morpholin-4-yl-4-oxidanylidene-N-[1-oxidanyl-1-(2-phenyl-1,3-dithian-2-yl)hexan-2-yl]-2-(phenylmethyl)sulfonyl-butanamide Openeye Name: 2-benzylsulfonyl-N-[1-[hydroxy-(2-phenyl-1,3-dithian-2-yl)methyl]pentyl]-2-methyl-4-morpholino-4-oxo-butanamide CAS Name: N-[1-hydroxy-1-(2-phenyl-1,3-dithian-2-yl)hexan-2-yl]-2-methyl-4-(4-morpholinyl)-4-oxo-2-(phenylmethyl)sulfonylbutanamide IUPAC Name: 2-benzylsulfonyl-N-[1-hydroxy-1-(2-phenyl-1,3-dithian-2-yl)hexan-2-yl]-2-methyl-4-morpholin-4-yl-4-oxobutanamide Traditional Name: 2-benzylsulfonyl-N-[1-[hydroxy-(2-phenyl-1,3-dithian-2-yl)methyl]pentyl]-4-keto-2-methyl-4-morpholino-butyramide Formula: C32H44N2O6S3 MolecularWeight: 648.89656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C1(SCCCS1)C2=CC=CC=C2)O)NC(=O)C(C)(CC(=O)N3CCOCC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CCCCC(C(C1(SCCCS1)C2=CC=CC=C2)O)NC(=O)C(C)(CC(=O)N3CCOCC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C32H44N2O6S3/c1-3-4-16-27(29(36)32(41-21-11-22-42-32)26-14-9-6-10-15-26)33-30(37)31(2,23-28(35)34-17-19-40-20-18-34)43(38,39)24-25-12-7-5-8-13-25/h5-10,12-15,27,29,36H,3-4,11,16-24H2,1-2H3,(H,33,37)