5-[(3-ethoxy-4-oxidanyl-phenyl)methylidene]-1-phenyl-3-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(3-ethoxy-4-oxidanyl-phenyl)methylidene]-1-phenyl-3-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-allyl-5-[(3-ethoxy-4-hydroxy-phenyl)methylene]-3-phenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-1-phenyl-3-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-1-phenyl-3-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-allyl-5-(3-ethoxy-4-hydroxy-benzylidene)-3-phenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C22H20N2O4S MolecularWeight: 408.4702

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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)CC=C)O

Isomeric SMILES

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

InChI

InChI=1S/C22H20N2O4S/c1-3-12-23-20(26)17(13-15-10-11-18(25)19(14-15)28-4-2)21(27)24(22(23)29)16-8-6-5-7-9-16/h3,5-11,13-14,25H,1,4,12H2,2H3