5-[2-(4-chloranylphenoxy)ethyliminomethyl]-1,3-dicyclohexyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[2-(4-chloranylphenoxy)ethyliminomethyl]-1,3-dicyclohexyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[2-(4-chlorophenoxy)ethyliminomethyl]-1,3-dicyclohexyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[2-(4-chlorophenoxy)ethyliminomethyl]-1,3-dicyclohexyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[2-(4-chlorophenoxy)ethyliminomethyl]-1,3-dicyclohexyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[2-(4-chlorophenoxy)ethyliminomethyl]-1,3-dicyclohexyl-barbituric acid Formula: C25H32ClN3O4 MolecularWeight: 473.99228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C(C(=O)N(C2=O)C3CCCCC3)C=NCCOC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(CC1)N2C(=O)C(C(=O)N(C2=O)C3CCCCC3)C=NCCOC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H32ClN3O4/c26-18-11-13-21(14-12-18)33-16-15-27-17-22-23(30)28(19-7-3-1-4-8-19)25(32)29(24(22)31)20-9-5-2-6-10-20/h11-14,17,19-20,22H,1-10,15-16H2