N-(9-bromanyl-5-oxidanylidene-2-phenyl-chromeno[4,3-d]pyrimidin-4-yl)propanamide

Systemtic Name: N-(9-bromanyl-5-oxidanylidene-2-phenyl-chromeno[4,3-d]pyrimidin-4-yl)propanamide Openeye Name: N-(9-bromo-5-oxo-2-phenyl-chromeno[4,3-d]pyrimidin-4-yl)propanamide CAS Name: N-(9-bromo-5-oxo-2-phenyl-4-[1]benzopyrano[4,3-d]pyrimidinyl)propanamide IUPAC Name: N-(9-bromo-5-oxo-2-phenylchromeno[4,3-d]pyrimidin-4-yl)propanamide Traditional Name: N-(9-bromo-5-keto-2-phenyl-chromeno[4,3-d]pyrimidin-4-yl)propionamide Formula: C20H14BrN3O3 MolecularWeight: 424.24746

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NC(=NC2=C1C(=O)OC3=C2C=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CCC(=O)NC1=NC(=NC2=C1C(=O)OC3=C2C=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C20H14BrN3O3/c1-2-15(25)22-19-16-17(23-18(24-19)11-6-4-3-5-7-11)13-10-12(21)8-9-14(13)27-20(16)26/h3-10H,2H2,1H3,(H,22,23,24,25)