2-[5-bromanyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-N-[3-(pyrazol-1-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-[5-bromanyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-N-[3-(pyrazol-1-ylmethyl)phenyl]ethanamide Openeye Name: 2-(5-bromo-2,4-dioxo-pyrimidin-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide CAS Name: 2-(5-bromo-2,4-dioxo-1-pyrimidinyl)-N-[3-(1-pyrazolylmethyl)phenyl]acetamide IUPAC Name: 2-(5-bromo-2,4-dioxopyrimidin-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide Traditional Name: 2-(5-bromo-2,4-diketo-pyrimidin-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide Formula: C16H14BrN5O3 MolecularWeight: 404.21806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CN2C=C(C(=O)NC2=O)Br)CN3C=CC=N3

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CN2C=C(C(=O)NC2=O)Br)CN3C=CC=N3

InChI

InChI=1S/C16H14BrN5O3/c17-13-9-21(16(25)20-15(13)24)10-14(23)19-12-4-1-3-11(7-12)8-22-6-2-5-18-22/h1-7,9H,8,10H2,(H,19,23)(H,20,24,25)