5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1,3-dicyclohexyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1,3-dicyclohexyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1,3-dicyclohexyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1,3-dicyclohexyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1,3-dicyclohexyl-1,3-diazinane-2,4,6-trione Traditional Name: 1,3-dicyclohexyl-5-(piperonyliminomethyl)barbituric acid Formula: C25H31N3O5 MolecularWeight: 453.53074

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C(C(=O)N(C2=O)C3CCCCC3)C=NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCC(CC1)N2C(=O)C(C(=O)N(C2=O)C3CCCCC3)C=NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H31N3O5/c29-23-20(15-26-14-17-11-12-21-22(13-17)33-16-32-21)24(30)28(19-9-5-2-6-10-19)25(31)27(23)18-7-3-1-4-8-18/h11-13,15,18-20H,1-10,14,16H2