N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3,4-dimethylphenyl)-4-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3,4-dimethylphenyl)-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-(3,4-dimethylphenyl)-4-oxo-pyridazine-3-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3,4-dimethylphenyl)-4-oxo-3-pyridazinecarboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3,4-dimethylphenyl)-4-oxopyridazine-3-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-(3,4-dimethylphenyl)-4-keto-pyridazine-3-carboxamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=CC(=O)C(=N2)C(=O)NC3=C(C4=C(S3)CCCC4)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=CC(=O)C(=N2)C(=O)NC3=C(C4=C(S3)CCCC4)C#N)C

InChI

InChI=1S/C22H20N4O2S/c1-13-7-8-15(11-14(13)2)26-10-9-18(27)20(25-26)21(28)24-22-17(12-23)16-5-3-4-6-19(16)29-22/h7-11H,3-6H2,1-2H3,(H,24,28)