(2S)-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: (2S)-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-(4-nitropyrazol-1-yl)propanamide Openeye Name: (2S)-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-(4-nitropyrazol-1-yl)propanamide CAS Name: (2S)-N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]-2-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: (2S)-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-(4-nitropyrazol-1-yl)propanamide Traditional Name: (2S)-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-(4-nitropyrazol-1-yl)propionamide Formula: C14H20N6O3 MolecularWeight: 320.347

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)C(C)N2C=C(C=N2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)[C@H](C)N2C=C(C=N2)[N+](=O)[O-])C

InChI

InChI=1S/C14H20N6O3/c1-10-7-11(2)18(17-10)6-4-5-15-14(21)12(3)19-9-13(8-16-19)20(22)23/h7-9,12H,4-6H2,1-3H3,(H,15,21)/t12-/m0/s1