N-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-2-sulfanyl-propanamide

Systemtic Name: N-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-2-sulfanyl-propanamide Openeye Name: N-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-2-sulfanyl-propanamide CAS Name: 2-mercapto-N-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]propanamide IUPAC Name: N-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-2-sulfanylpropanamide Traditional Name: N-[4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-2-mercapto-propionamide Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NN=C1C2=CC=C(C=C2)NC(=O)C(C)S

Isomeric SMILES

CC1CC(=O)NN=C1C2=CC=C(C=C2)NC(=O)C(C)S

InChI

InChI=1S/C14H17N3O2S/c1-8-7-12(18)16-17-13(8)10-3-5-11(6-4-10)15-14(19)9(2)20/h3-6,8-9,20H,7H2,1-2H3,(H,15,19)(H,16,18)