N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide

Systemtic Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide Openeye Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-6-oxo-1-propyl-pyridazine-3-carboxamide CAS Name: N-[4-[(2,5-dimethylphenyl)thio]phenyl]-6-oxo-1-propyl-3-pyridazinecarboxamide IUPAC Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-6-oxo-1-propylpyridazine-3-carboxamide Traditional Name: N-[4-[(2,5-dimethylphenyl)thio]phenyl]-6-keto-1-propyl-pyridazine-3-carboxamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)SC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)SC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C22H23N3O2S/c1-4-13-25-21(26)12-11-19(24-25)22(27)23-17-7-9-18(10-8-17)28-20-14-15(2)5-6-16(20)3/h5-12,14H,4,13H2,1-3H3,(H,23,27)