5-[[3-methoxy-4-(5-nitropyridin-2-yl)oxy-phenyl]methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[3-methoxy-4-(5-nitropyridin-2-yl)oxy-phenyl]methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[3-methoxy-4-[(5-nitro-2-pyridyl)oxy]phenyl]methylene]-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[3-methoxy-4-[(5-nitro-2-pyridinyl)oxy]phenyl]methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[3-methoxy-4-(5-nitropyridin-2-yl)oxyphenyl]methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[3-methoxy-4-[(5-nitro-2-pyridyl)oxy]benzylidene]-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C29H20N4O6S MolecularWeight: 552.5573

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)OC5=NC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)OC5=NC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H20N4O6S/c1-38-25-17-19(12-14-24(25)39-26-15-13-22(18-30-26)33(36)37)16-23-27(34)31(20-8-4-2-5-9-20)29(40)32(28(23)35)21-10-6-3-7-11-21/h2-18H,1H3