N-(cyanomethyl)-N-methyl-1-phenyl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-(cyanomethyl)-N-methyl-1-phenyl-1,2,4-triazole-3-carboxamide Openeye Name: N-(cyanomethyl)-N-methyl-1-phenyl-1,2,4-triazole-3-carboxamide CAS Name: N-(cyanomethyl)-N-methyl-1-phenyl-1,2,4-triazole-3-carboxamide IUPAC Name: N-(cyanomethyl)-N-methyl-1-phenyl-1,2,4-triazole-3-carboxamide Traditional Name: N-(cyanomethyl)-N-methyl-1-phenyl-1,2,4-triazole-3-carboxamide Formula: C12H11N5O MolecularWeight: 241.24864

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC#N)C(=O)C1=NN(C=N1)C2=CC=CC=C2

Isomeric SMILES

CN(CC#N)C(=O)C1=NN(C=N1)C2=CC=CC=C2

InChI

InChI=1S/C12H11N5O/c1-16(8-7-13)12(18)11-14-9-17(15-11)10-5-3-2-4-6-10/h2-6,9H,8H2,1H3