3-methoxy-1-methyl-N-[5-[(3-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide

Systemtic Name: 3-methoxy-1-methyl-N-[5-[(3-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Openeye Name: 3-methoxy-1-methyl-N-[5-[(3-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide CAS Name: 3-methoxy-1-methyl-N-[5-[(3-nitrophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-4-pyrazolecarboxamide IUPAC Name: 3-methoxy-1-methyl-N-[5-[(3-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Traditional Name: 3-methoxy-1-methyl-N-[5-[(3-nitrobenzyl)thio]-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Formula: C15H14N6O4S2 MolecularWeight: 406.43946

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)OC)C(=O)NC2=NN=C(S2)SCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C(=N1)OC)C(=O)NC2=NN=C(S2)SCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H14N6O4S2/c1-20-7-11(13(19-20)25-2)12(22)16-14-17-18-15(27-14)26-8-9-4-3-5-10(6-9)21(23)24/h3-7H,8H2,1-2H3,(H,16,17,22)