1-(3-chloranyl-4-methyl-phenyl)-5-[(3-methoxy-5-prop-2-enyl-4-prop-2-ynoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-5-[(3-methoxy-5-prop-2-enyl-4-prop-2-ynoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(3-allyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylene]-1-(3-chloro-4-methyl-phenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 1-(3-chloro-4-methylphenyl)-5-[(3-methoxy-5-prop-2-enyl-4-prop-2-ynoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(3-chloro-4-methylphenyl)-5-[(3-methoxy-5-prop-2-enyl-4-prop-2-ynoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-(3-allyl-5-methoxy-4-propargyloxy-benzylidene)-1-(3-chloro-4-methyl-phenyl)barbituric acid Formula: C25H21ClN2O5 MolecularWeight: 464.89764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)OCC#C)CC=C)C(=O)NC2=O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)OCC#C)CC=C)C(=O)NC2=O)Cl

InChI

InChI=1S/C25H21ClN2O5/c1-5-7-17-11-16(13-21(32-4)22(17)33-10-6-2)12-19-23(29)27-25(31)28(24(19)30)18-9-8-15(3)20(26)14-18/h2,5,8-9,11-14H,1,7,10H2,3-4H3,(H,27,29,31)