6-methyl-4-oxidanylidene-1-phenyl-N-[2-(phenylmethylsulfanyl)ethyl]pyridazine-3-carboxamide

Systemtic Name: 6-methyl-4-oxidanylidene-1-phenyl-N-[2-(phenylmethylsulfanyl)ethyl]pyridazine-3-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-6-methyl-4-oxo-1-phenyl-pyridazine-3-carboxamide CAS Name: 6-methyl-4-oxo-1-phenyl-N-[2-(phenylmethylthio)ethyl]-3-pyridazinecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-4-keto-6-methyl-1-phenyl-pyridazine-3-carboxamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2)C(=O)NCCSCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2)C(=O)NCCSCC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S/c1-16-14-19(25)20(23-24(16)18-10-6-3-7-11-18)21(26)22-12-13-27-15-17-8-4-2-5-9-17/h2-11,14H,12-13,15H2,1H3,(H,22,26)