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

Systemtic Name: 5-[(3-ethoxy-5-prop-2-enyl-4-prop-2-ynoxy-phenyl)methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3-allyl-5-ethoxy-4-prop-2-ynoxy-phenyl)methylene]-1-(4-ethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3-ethoxy-5-prop-2-enyl-4-prop-2-ynoxyphenyl)methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3-ethoxy-5-prop-2-enyl-4-prop-2-ynoxyphenyl)methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3-allyl-5-ethoxy-4-propargyloxy-benzylidene)-1-(4-ethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C27H26N2O4S MolecularWeight: 474.57134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26N2O4S/c1-5-9-20-15-19(17-23(32-8-4)24(20)33-14-6-2)16-22-25(30)28-27(34)29(26(22)31)21-12-10-18(7-3)11-13-21/h2,5,10-13,15-17H,1,7-9,14H2,3-4H3,(H,28,30,34)