N-[1-(4-methylphenyl)propyl]-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[1-(4-methylphenyl)propyl]-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide Openeye Name: 1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[1-(p-tolyl)propyl]pyrazole-3-carboxamide CAS Name: N-[1-(4-methylphenyl)propyl]-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[1-(4-methylphenyl)propyl]-1-[(3-nitro-1,2,4-triazol-1-yl)methyl]pyrazole-3-carboxamide Traditional Name: 1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[1-(p-tolyl)propyl]pyrazole-3-carboxamide Formula: C17H19N7O3 MolecularWeight: 369.37786

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C)NC(=O)C2=NN(C=C2)CN3C=NC(=N3)[N+](=O)[O-]

Isomeric SMILES

CCC(C1=CC=C(C=C1)C)NC(=O)C2=NN(C=C2)CN3C=NC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N7O3/c1-3-14(13-6-4-12(2)5-7-13)19-16(25)15-8-9-22(20-15)11-23-10-18-17(21-23)24(26)27/h4-10,14H,3,11H2,1-2H3,(H,19,25)