(5E)-1-(4-ethylphenyl)-5-[(3-methoxy-5-prop-2-enyl-4-prop-2-ynoxy-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5E)-1-(4-ethylphenyl)-5-[(3-methoxy-5-prop-2-enyl-4-prop-2-ynoxy-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-5-[(3-allyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylene]-1-(4-ethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-1-(4-ethylphenyl)-5-[(3-methoxy-5-prop-2-enyl-4-prop-2-ynoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-1-(4-ethylphenyl)-5-[(3-methoxy-5-prop-2-enyl-4-prop-2-ynoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-5-(3-allyl-5-methoxy-4-propargyloxy-benzylidene)-1-(4-ethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C26H24N2O4S MolecularWeight: 460.54476

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)OCC#C)CC=C)C(=O)NC2=S

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC(=C(C(=C3)OC)OCC#C)CC=C)/C(=O)NC2=S

InChI

InChI=1S/C26H24N2O4S/c1-5-8-19-14-18(16-22(31-4)23(19)32-13-6-2)15-21-24(29)27-26(33)28(25(21)30)20-11-9-17(7-3)10-12-20/h2,5,9-12,14-16H,1,7-8,13H2,3-4H3,(H,27,29,33)/b21-15+