1-cyclohexyl-5-[(3-iodanyl-5-methoxy-4-propan-2-yloxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-cyclohexyl-5-[(3-iodanyl-5-methoxy-4-propan-2-yloxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-cyclohexyl-5-[(3-iodo-4-isopropoxy-5-methoxy-phenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-cyclohexyl-5-[(3-iodo-5-methoxy-4-propan-2-yloxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-cyclohexyl-5-[(3-iodo-5-methoxy-4-propan-2-yloxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-cyclohexyl-5-(3-iodo-4-isopropoxy-5-methoxy-benzylidene)barbituric acid Formula: C21H25IN2O5 MolecularWeight: 512.33807

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1I)C=C2C(=O)NC(=O)N(C2=O)C3CCCCC3)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1I)C=C2C(=O)NC(=O)N(C2=O)C3CCCCC3)OC

InChI

InChI=1S/C21H25IN2O5/c1-12(2)29-18-16(22)10-13(11-17(18)28-3)9-15-19(25)23-21(27)24(20(15)26)14-7-5-4-6-8-14/h9-12,14H,4-8H2,1-3H3,(H,23,25,27)