(2S)-2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(2-ethylphenyl)propanamide

Systemtic Name: (2S)-2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(2-ethylphenyl)propanamide Openeye Name: (2S)-2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-(2-ethylphenyl)propanamide CAS Name: (2S)-2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-(2-ethylphenyl)propanamide IUPAC Name: (2S)-2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(2-ethylphenyl)propanamide Traditional Name: (2S)-2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-(2-ethylphenyl)propionamide Formula: C15H17BrN4O3 MolecularWeight: 381.22448

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C(C)N2C(=C(C(=N2)[N+](=O)[O-])Br)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)[C@H](C)N2C(=C(C(=N2)[N+](=O)[O-])Br)C

InChI

InChI=1S/C15H17BrN4O3/c1-4-11-7-5-6-8-12(11)17-15(21)10(3)19-9(2)13(16)14(18-19)20(22)23/h5-8,10H,4H2,1-3H3,(H,17,21)/t10-/m0/s1