5-[[(2-chloranylpyridin-3-yl)amino]methylidene]-1,3-dicyclohexyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[(2-chloranylpyridin-3-yl)amino]methylidene]-1,3-dicyclohexyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[(2-chloro-3-pyridyl)amino]methylene]-1,3-dicyclohexyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[(2-chloro-3-pyridinyl)amino]methylidene]-1,3-dicyclohexyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[(2-chloropyridin-3-yl)amino]methylidene]-1,3-dicyclohexyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[(2-chloro-3-pyridyl)amino]methylene]-1,3-dicyclohexyl-barbituric acid Formula: C22H27ClN4O3 MolecularWeight: 430.92778

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C(=CNC3=C(N=CC=C3)Cl)C(=O)N(C2=O)C4CCCCC4

Isomeric SMILES

C1CCC(CC1)N2C(=O)C(=CNC3=C(N=CC=C3)Cl)C(=O)N(C2=O)C4CCCCC4

InChI

InChI=1S/C22H27ClN4O3/c23-19-18(12-7-13-24-19)25-14-17-20(28)26(15-8-3-1-4-9-15)22(30)27(21(17)29)16-10-5-2-6-11-16/h7,12-16,25H,1-6,8-11H2