1-(3-aminophenyl)-N,N-bis(cyanomethyl)pyrazole-3-carboxamide

Systemtic Name: 1-(3-aminophenyl)-N,N-bis(cyanomethyl)pyrazole-3-carboxamide Openeye Name: 1-(3-aminophenyl)-N,N-bis(cyanomethyl)pyrazole-3-carboxamide CAS Name: 1-(3-aminophenyl)-N,N-bis(cyanomethyl)-3-pyrazolecarboxamide IUPAC Name: 1-(3-aminophenyl)-N,N-bis(cyanomethyl)pyrazole-3-carboxamide Traditional Name: 1-(3-aminophenyl)-N,N-bis(cyanomethyl)pyrazole-3-carboxamide Formula: C14H12N6O MolecularWeight: 280.28468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)N2C=CC(=N2)C(=O)N(CC#N)CC#N

Isomeric SMILES

C1=CC(=CC(=C1)N)N2C=CC(=N2)C(=O)N(CC#N)CC#N

InChI

InChI=1S/C14H12N6O/c15-5-8-19(9-6-16)14(21)13-4-7-20(18-13)12-3-1-2-11(17)10-12/h1-4,7,10H,8-9,17H2