5-[[(3-ethynylphenyl)amino]methylidene]-1,3-diphenyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[(3-ethynylphenyl)amino]methylidene]-1,3-diphenyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(3-ethynylanilino)methylene]-1,3-diphenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(3-ethynylanilino)methylidene]-1,3-diphenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(3-ethynylanilino)methylidene]-1,3-diphenyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(3-ethynylanilino)methylene]-1,3-diphenyl-barbituric acid Formula: C25H17N3O3 MolecularWeight: 407.42078

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC=C2C(=O)N(C(=O)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C#CC1=CC(=CC=C1)NC=C2C(=O)N(C(=O)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H17N3O3/c1-2-18-10-9-11-19(16-18)26-17-22-23(29)27(20-12-5-3-6-13-20)25(31)28(24(22)30)21-14-7-4-8-15-21/h1,3-17,26H