N-methyl-N-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]-1-(1-phenylpyrazol-4-yl)methanamine

Systemtic Name: N-methyl-N-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]-1-(1-phenylpyrazol-4-yl)methanamine Openeye Name: N-methyl-N-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]-1-(1-phenylpyrazol-4-yl)methanamine CAS Name: N-methyl-N-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]-1-(1-phenyl-4-pyrazolyl)methanamine IUPAC Name: N-methyl-N-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]-1-(1-phenylpyrazol-4-yl)methanamine Traditional Name: methyl-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]-[(1-phenylpyrazol-4-yl)methyl]amine Formula: C20H19N7O2 MolecularWeight: 389.41056

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)CN3C=NC(=N3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)CN3C=NC(=N3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H19N7O2/c1-24(12-16-11-22-26(13-16)18-5-3-2-4-6-18)15-25-14-21-20(23-25)17-7-9-19(10-8-17)27(28)29/h2-11,13-14H,12,15H2,1H3