2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]acetamide Formula: C14H20N6O3S MolecularWeight: 352.412

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)CN2C(=C(C(=N2)C)[N+](=O)[O-])C

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)CN2C(=C(C(=N2)C)[N+](=O)[O-])C

InChI

InChI=1S/C14H20N6O3S/c1-5-10(6-2)13-16-17-14(24-13)15-11(21)7-19-9(4)12(20(22)23)8(3)18-19/h10H,5-7H2,1-4H3,(H,15,17,21)