1-[7-(4-bromophenyl)carbonyl-3-phenyl-pyrrolo[1,2-c]pyrimidin-5-yl]ethanone

Systemtic Name: 1-[7-(4-bromophenyl)carbonyl-3-phenyl-pyrrolo[1,2-c]pyrimidin-5-yl]ethanone Openeye Name: 1-[7-(4-bromobenzoyl)-3-phenyl-pyrrolo[1,2-c]pyrimidin-5-yl]ethanone CAS Name: 1-[7-[(4-bromophenyl)-oxomethyl]-3-phenyl-5-pyrrolo[1,2-c]pyrimidinyl]ethanone IUPAC Name: 1-[7-(4-bromobenzoyl)-3-phenylpyrrolo[1,2-c]pyrimidin-5-yl]ethanone Traditional Name: 1-[7-(4-bromobenzoyl)-3-phenyl-pyrrolo[1,2-c]pyrimidin-5-yl]ethanone Formula: C22H15BrN2O2 MolecularWeight: 419.2707

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C2C=C(N=CN2C(=C1)C(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=C2C=C(N=CN2C(=C1)C(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H15BrN2O2/c1-14(26)18-11-21(22(27)16-7-9-17(23)10-8-16)25-13-24-19(12-20(18)25)15-5-3-2-4-6-15/h2-13H,1H3