2-(4-nitropyrazol-1-yl)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)propanamide

Systemtic Name: 2-(4-nitropyrazol-1-yl)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: 2-(4-nitropyrazol-1-yl)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)propanamide CAS Name: 2-(4-nitro-1-pyrazolyl)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 2-(4-nitropyrazol-1-yl)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: 2-(4-nitropyrazol-1-yl)-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)propionamide Formula: C16H16N6O3S MolecularWeight: 372.40164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NN=C(S1)CCC2=CC=CC=C2)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=NN=C(S1)CCC2=CC=CC=C2)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N6O3S/c1-11(21-10-13(9-17-21)22(24)25)15(23)18-16-20-19-14(26-16)8-7-12-5-3-2-4-6-12/h2-6,9-11H,7-8H2,1H3,(H,18,20,23)