5-[(3-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(3-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(4-allyloxy-3-bromo-5-ethoxy-phenyl)methylene]-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3-bromo-5-ethoxy-4-prop-2-enoxyphenyl)methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3-bromo-5-ethoxy-4-prop-2-enoxyphenyl)methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(4-allyloxy-3-bromo-5-ethoxy-benzylidene)-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C28H23BrN2O4S MolecularWeight: 563.46222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)Br)OCC=C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)Br)OCC=C

InChI

InChI=1S/C28H23BrN2O4S/c1-3-15-35-25-23(29)17-19(18-24(25)34-4-2)16-22-26(32)30(20-11-7-5-8-12-20)28(36)31(27(22)33)21-13-9-6-10-14-21/h3,5-14,16-18H,1,4,15H2,2H3