2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(thiophen-2-ylmethyl)propanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(thiophen-2-ylmethyl)propanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(2-thienylmethyl)propanamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-(thiophen-2-ylmethyl)propanamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(thiophen-2-ylmethyl)propanamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(2-thenyl)propionamide Formula: C13H16N4O3S MolecularWeight: 308.35614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)NCC2=CC=CS2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C(C)C(=O)NCC2=CC=CS2)C)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O3S/c1-8-12(17(19)20)9(2)16(15-8)10(3)13(18)14-7-11-5-4-6-21-11/h4-6,10H,7H2,1-3H3,(H,14,18)