1-(4-aminophenyl)-N,N-bis(cyanomethyl)pyrazole-3-carboxamide

Systemtic Name: 1-(4-aminophenyl)-N,N-bis(cyanomethyl)pyrazole-3-carboxamide Openeye Name: 1-(4-aminophenyl)-N,N-bis(cyanomethyl)pyrazole-3-carboxamide CAS Name: 1-(4-aminophenyl)-N,N-bis(cyanomethyl)-3-pyrazolecarboxamide IUPAC Name: 1-(4-aminophenyl)-N,N-bis(cyanomethyl)pyrazole-3-carboxamide Traditional Name: 1-(4-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=C1N)N2C=CC(=N2)C(=O)N(CC#N)CC#N

Isomeric SMILES

C1=CC(=CC=C1N)N2C=CC(=N2)C(=O)N(CC#N)CC#N

InChI

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