1-(4-bromophenyl)-5-[[1-(3-phenoxypropyl)indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(4-bromophenyl)-5-[[1-(3-phenoxypropyl)indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(4-bromophenyl)-5-[[1-(3-phenoxypropyl)indol-3-yl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(4-bromophenyl)-5-[[1-(3-phenoxypropyl)-3-indolyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(4-bromophenyl)-5-[[1-(3-phenoxypropyl)indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(4-bromophenyl)-5-[[1-(3-phenoxypropyl)indol-3-yl]methylene]barbituric acid Formula: C28H22BrN3O4 MolecularWeight: 544.39598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCN2C=C(C3=CC=CC=C32)C=C4C(=O)NC(=O)N(C4=O)C5=CC=C(C=C5)Br

Isomeric SMILES

C1=CC=C(C=C1)OCCCN2C=C(C3=CC=CC=C32)C=C4C(=O)NC(=O)N(C4=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C28H22BrN3O4/c29-20-11-13-21(14-12-20)32-27(34)24(26(33)30-28(32)35)17-19-18-31(25-10-5-4-9-23(19)25)15-6-16-36-22-7-2-1-3-8-22/h1-5,7-14,17-18H,6,15-16H2,(H,30,33,35)