4-azido-N-(4-bromophenyl)-5-cyano-2-(4-methoxyphenyl)pyrazole-3-carboxamide

Systemtic Name: 4-azido-N-(4-bromophenyl)-5-cyano-2-(4-methoxyphenyl)pyrazole-3-carboxamide Openeye Name: 4-azido-N-(4-bromophenyl)-5-cyano-2-(4-methoxyphenyl)pyrazole-3-carboxamide CAS Name: 4-azido-N-(4-bromophenyl)-5-cyano-2-(4-methoxyphenyl)-3-pyrazolecarboxamide IUPAC Name: 4-azido-N-(4-bromophenyl)-5-cyano-2-(4-methoxyphenyl)pyrazole-3-carboxamide Traditional Name: 4-azido-N-(4-bromophenyl)-5-cyano-2-(4-methoxyphenyl)pyrazole-3-carboxamide Formula: C18H12BrN7O2 MolecularWeight: 438.23758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=C(C(=N2)C#N)N=[N+]=[N-])C(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=C(C(=N2)C#N)N=[N+]=[N-])C(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H12BrN7O2/c1-28-14-8-6-13(7-9-14)26-17(16(23-25-21)15(10-20)24-26)18(27)22-12-4-2-11(19)3-5-12/h2-9H,1H3,(H,22,27)