2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)acetamide Formula: C16H15BrN6O3S MolecularWeight: 451.2977

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=NN=C(S2)CCC3=CC=CC=C3)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=NN=C(S2)CCC3=CC=CC=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C16H15BrN6O3S/c1-10-14(17)15(23(25)26)21-22(10)9-12(24)18-16-20-19-13(27-16)8-7-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3,(H,18,20,24)