5-(nonan-5-yliminomethyl)-1-phenyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(nonan-5-yliminomethyl)-1-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-(1-butylpentyliminomethyl)-1-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-(nonan-5-yliminomethyl)-1-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(nonan-5-yliminomethyl)-1-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(1-butylpentyliminomethyl)-1-phenyl-barbituric acid Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)N=CC1C(=O)NC(=O)N(C1=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC(CCCC)N=CC1C(=O)NC(=O)N(C1=O)C2=CC=CC=C2

InChI

InChI=1S/C20H27N3O3/c1-3-5-10-15(11-6-4-2)21-14-17-18(24)22-20(26)23(19(17)25)16-12-8-7-9-13-16/h7-9,12-15,17H,3-6,10-11H2,1-2H3,(H,22,24,26)