1-(4-methylphenyl)sulfonyl-4-[(2S)-1-[(4-methylphenyl)sulfonylmethoxy]-3-phenyl-propan-2-yl]-1,4-diazepan-5-one

Systemtic Name: 1-(4-methylphenyl)sulfonyl-4-[(2S)-1-[(4-methylphenyl)sulfonylmethoxy]-3-phenyl-propan-2-yl]-1,4-diazepan-5-one Openeye Name: 4-[(1S)-1-benzyl-2-(p-tolylsulfonylmethoxy)ethyl]-1-(p-tolylsulfonyl)-1,4-diazepan-5-one CAS Name: 1-(4-methylphenyl)sulfonyl-4-[(2S)-1-[(4-methylphenyl)sulfonylmethoxy]-3-phenylpropan-2-yl]-1,4-diazepan-5-one IUPAC Name: 1-(4-methylphenyl)sulfonyl-4-[(2S)-1-[(4-methylphenyl)sulfonylmethoxy]-3-phenylpropan-2-yl]-1,4-diazepan-5-one Traditional Name: 4-[(1S)-1-benzyl-2-(tosylmethoxy)ethyl]-1-tosyl-1,4-diazepan-5-one Formula: C29H34N2O6S2 MolecularWeight: 570.72006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)COCC(CC2=CC=CC=C2)N3CCN(CCC3=O)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)COC[C@H](CC2=CC=CC=C2)N3CCN(CCC3=O)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C29H34N2O6S2/c1-23-8-12-27(13-9-23)38(33,34)22-37-21-26(20-25-6-4-3-5-7-25)31-19-18-30(17-16-29(31)32)39(35,36)28-14-10-24(2)11-15-28/h3-15,26H,16-22H2,1-2H3/t26-/m0/s1