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

Systemtic Name: 5-[[(2-chloranylpyridin-3-yl)amino]methylidene]-1-phenethyl-3-propan-2-yl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[(2-chloro-3-pyridyl)amino]methylene]-1-isopropyl-3-phenethyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[(2-chloro-3-pyridinyl)amino]methylidene]-1-phenethyl-3-propan-2-yl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[(2-chloropyridin-3-yl)amino]methylidene]-1-phenethyl-3-propan-2-yl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[(2-chloro-3-pyridyl)amino]methylene]-1-isopropyl-3-phenethyl-barbituric acid Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C(=CNC2=C(N=CC=C2)Cl)C(=O)N(C1=O)CCC3=CC=CC=C3

Isomeric SMILES

CC(C)N1C(=O)C(=CNC2=C(N=CC=C2)Cl)C(=O)N(C1=O)CCC3=CC=CC=C3

InChI

InChI=1S/C21H21ClN4O3/c1-14(2)26-20(28)16(13-24-17-9-6-11-23-18(17)22)19(27)25(21(26)29)12-10-15-7-4-3-5-8-15/h3-9,11,13-14,24H,10,12H2,1-2H3