N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-methyl-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-methyl-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-methyl-6-oxo-pyridazine-3-carboxamide CAS Name: N-[5-[(4-cyanophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-1-methyl-6-oxo-3-pyridazinecarboxamide IUPAC Name: N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-methyl-6-oxopyridazine-3-carboxamide Traditional Name: N-[5-[(4-cyanobenzyl)thio]-1,3,4-thiadiazol-2-yl]-6-keto-1-methyl-pyridazine-3-carboxamide Formula: C16H12N6O2S2 MolecularWeight: 384.43548

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=CC(=N1)C(=O)NC2=NN=C(S2)SCC3=CC=C(C=C3)C#N

Isomeric SMILES

CN1C(=O)C=CC(=N1)C(=O)NC2=NN=C(S2)SCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H12N6O2S2/c1-22-13(23)7-6-12(21-22)14(24)18-15-19-20-16(26-15)25-9-11-4-2-10(8-17)3-5-11/h2-7H,9H2,1H3,(H,18,19,24)