N-[2-(3,4-dimethylphenyl)sulfanylethyl]-1-methyl-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-1-methyl-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-1-methyl-6-oxo-pyridazine-3-carboxamide CAS Name: N-[2-[(3,4-dimethylphenyl)thio]ethyl]-1-methyl-6-oxo-3-pyridazinecarboxamide IUPAC Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-1-methyl-6-oxopyridazine-3-carboxamide Traditional Name: N-[2-[(3,4-dimethylphenyl)thio]ethyl]-6-keto-1-methyl-pyridazine-3-carboxamide Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCNC(=O)C2=NN(C(=O)C=C2)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCNC(=O)C2=NN(C(=O)C=C2)C)C

InChI

InChI=1S/C16H19N3O2S/c1-11-4-5-13(10-12(11)2)22-9-8-17-16(21)14-6-7-15(20)19(3)18-14/h4-7,10H,8-9H2,1-3H3,(H,17,21)