3-(4-methylphenyl)sulfonyl-7-(1-methylsulfonyl-2-oxidanylidene-3-phenyl-imidazolidin-4-yl)-1-phenyl-4,5-dihydro-1,3-diazepin-2-one

Systemtic Name: 3-(4-methylphenyl)sulfonyl-7-(1-methylsulfonyl-2-oxidanylidene-3-phenyl-imidazolidin-4-yl)-1-phenyl-4,5-dihydro-1,3-diazepin-2-one Openeye Name: 7-(1-methylsulfonyl-2-oxo-3-phenyl-imidazolidin-4-yl)-1-phenyl-3-(p-tolylsulfonyl)-4,5-dihydro-1,3-diazepin-2-one CAS Name: 3-(4-methylphenyl)sulfonyl-7-(1-methylsulfonyl-2-oxo-3-phenyl-4-imidazolidinyl)-1-phenyl-4,5-dihydro-1,3-diazepin-2-one IUPAC Name: 3-(4-methylphenyl)sulfonyl-7-(1-methylsulfonyl-2-oxo-3-phenylimidazolidin-4-yl)-1-phenyl-4,5-dihydro-1,3-diazepin-2-one Traditional Name: 7-(2-keto-1-mesyl-3-phenyl-imidazolidin-4-yl)-1-phenyl-3-tosyl-4,5-dihydro-1,3-diazepin-2-one Formula: C28H28N4O6S2 MolecularWeight: 580.67512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC=C(N(C2=O)C3=CC=CC=C3)C4CN(C(=O)N4C5=CC=CC=C5)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC=C(N(C2=O)C3=CC=CC=C3)C4CN(C(=O)N4C5=CC=CC=C5)S(=O)(=O)C

InChI

InChI=1S/C28H28N4O6S2/c1-21-15-17-24(18-16-21)40(37,38)29-19-9-14-25(31(27(29)33)22-10-5-3-6-11-22)26-20-30(39(2,35)36)28(34)32(26)23-12-7-4-8-13-23/h3-8,10-18,26H,9,19-20H2,1-2H3