N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide

Systemtic Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide Openeye Name: 1-benzyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-6-oxo-pyridazine-3-carboxamide CAS Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-6-oxo-1-(phenylmethyl)-3-pyridazinecarboxamide IUPAC Name: 1-benzyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-6-oxopyridazine-3-carboxamide Traditional Name: 1-benzyl-6-keto-N-[2-(methylthio)-1,3-benzothiazol-6-yl]pyridazine-3-carboxamide Formula: C20H16N4O2S2 MolecularWeight: 408.49664

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C20H16N4O2S2/c1-27-20-22-15-8-7-14(11-17(15)28-20)21-19(26)16-9-10-18(25)24(23-16)12-13-5-3-2-4-6-13/h2-11H,12H2,1H3,(H,21,26)