5-[[4-[(4-methyl-3-nitro-phenyl)sulfonylmethyl]phenyl]methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[4-[(4-methyl-3-nitro-phenyl)sulfonylmethyl]phenyl]methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[4-[(4-methyl-3-nitro-phenyl)sulfonylmethyl]phenyl]methylene]-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[4-[(4-methyl-3-nitrophenyl)sulfonylmethyl]phenyl]methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[4-[(4-methyl-3-nitrophenyl)sulfonylmethyl]phenyl]methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[4-[(4-methyl-3-nitro-phenyl)sulfonylmethyl]benzylidene]-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C31H23N3O6S2 MolecularWeight: 597.66082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)CC2=CC=C(C=C2)C=C3C(=O)N(C(=S)N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)CC2=CC=C(C=C2)C=C3C(=O)N(C(=S)N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C31H23N3O6S2/c1-21-12-17-26(19-28(21)34(37)38)42(39,40)20-23-15-13-22(14-16-23)18-27-29(35)32(24-8-4-2-5-9-24)31(41)33(30(27)36)25-10-6-3-7-11-25/h2-19H,20H2,1H3