2-(3-methyl-4-nitro-pyrazol-1-yl)-N-[1-(phenylmethyl)-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 2-(3-methyl-4-nitro-pyrazol-1-yl)-N-[1-(phenylmethyl)-1,2,4-triazol-3-yl]propanamide Openeye Name: N-(1-benzyl-1,2,4-triazol-3-yl)-2-(3-methyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: 2-(3-methyl-4-nitro-1-pyrazolyl)-N-[1-(phenylmethyl)-1,2,4-triazol-3-yl]propanamide IUPAC Name: N-(1-benzyl-1,2,4-triazol-3-yl)-2-(3-methyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-(1-benzyl-1,2,4-triazol-3-yl)-2-(3-methyl-4-nitro-pyrazol-1-yl)propionamide Formula: C16H17N7O3 MolecularWeight: 355.35128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1[N+](=O)[O-])C(C)C(=O)NC2=NN(C=N2)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C=C1[N+](=O)[O-])C(C)C(=O)NC2=NN(C=N2)CC3=CC=CC=C3

InChI

InChI=1S/C16H17N7O3/c1-11-14(23(25)26)9-22(19-11)12(2)15(24)18-16-17-10-21(20-16)8-13-6-4-3-5-7-13/h3-7,9-10,12H,8H2,1-2H3,(H,18,20,24)