N-(2-azanylethyl)-1-methyl-4-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-methyl-4-phenyl-pyrazole-3-carboxamide Openeye Name: N-(2-aminoethyl)-1-methyl-4-phenyl-pyrazole-3-carboxamide CAS Name: N-(2-aminoethyl)-1-methyl-4-phenyl-3-pyrazolecarboxamide IUPAC Name: N-(2-aminoethyl)-1-methyl-4-phenylpyrazole-3-carboxamide Traditional Name: N-(2-aminoethyl)-1-methyl-4-phenyl-pyrazole-3-carboxamide Formula: C13H16N4O MolecularWeight: 244.29234

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NCCN)C2=CC=CC=C2

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NCCN)C2=CC=CC=C2

InChI

InChI=1S/C13H16N4O/c1-17-9-11(10-5-3-2-4-6-10)12(16-17)13(18)15-8-7-14/h2-6,9H,7-8,14H2,1H3,(H,15,18)