4-bromanyl-N-[6-oxidanylidene-4-(2,3,4-trimethoxyphenyl)-4,5-dihydro-1H-pyrimidin-2-yl]benzamide

Systemtic Name: 4-bromanyl-N-[6-oxidanylidene-4-(2,3,4-trimethoxyphenyl)-4,5-dihydro-1H-pyrimidin-2-yl]benzamide Openeye Name: 4-bromo-N-[6-oxo-4-(2,3,4-trimethoxyphenyl)-4,5-dihydro-1H-pyrimidin-2-yl]benzamide CAS Name: 4-bromo-N-[6-oxo-4-(2,3,4-trimethoxyphenyl)-4,5-dihydro-1H-pyrimidin-2-yl]benzamide IUPAC Name: 4-bromo-N-[6-oxo-4-(2,3,4-trimethoxyphenyl)-4,5-dihydro-1H-pyrimidin-2-yl]benzamide Traditional Name: 4-bromo-N-[6-keto-4-(2,3,4-trimethoxyphenyl)-4,5-dihydro-1H-pyrimidin-2-yl]benzamide Formula: C20H20BrN3O5 MolecularWeight: 462.2939

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2CC(=O)NC(=N2)NC(=O)C3=CC=C(C=C3)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2CC(=O)NC(=N2)NC(=O)C3=CC=C(C=C3)Br)OC)OC

InChI

InChI=1S/C20H20BrN3O5/c1-27-15-9-8-13(17(28-2)18(15)29-3)14-10-16(25)23-20(22-14)24-19(26)11-4-6-12(21)7-5-11/h4-9,14H,10H2,1-3H3,(H2,22,23,24,25,26)