4,5-bis(bromanyl)-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]-1H-pyrazole-3-carboxamide

Systemtic Name: 4,5-bis(bromanyl)-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]-1H-pyrazole-3-carboxamide Openeye Name: 4,5-dibromo-N-[1-(1-naphthylmethyl)pyrazol-3-yl]-1H-pyrazole-3-carboxamide CAS Name: 4,5-dibromo-N-[1-(1-naphthalenylmethyl)-3-pyrazolyl]-1H-pyrazole-3-carboxamide IUPAC Name: 4,5-dibromo-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]-1H-pyrazole-3-carboxamide Traditional Name: 4,5-dibromo-N-[1-(1-naphthylmethyl)pyrazol-3-yl]-1H-pyrazole-3-carboxamide Formula: C18H13Br2N5O MolecularWeight: 475.13672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CN3C=CC(=N3)NC(=O)C4=NNC(=C4Br)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CN3C=CC(=N3)NC(=O)C4=NNC(=C4Br)Br

InChI

InChI=1S/C18H13Br2N5O/c19-15-16(22-23-17(15)20)18(26)21-14-8-9-25(24-14)10-12-6-3-5-11-4-1-2-7-13(11)12/h1-9H,10H2,(H,22,23)(H,21,24,26)