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

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3-methylphenyl)-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-(m-tolyl)-4-oxo-pyridazine-3-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3-methylphenyl)-4-oxo-3-pyridazinecarboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(3-methylphenyl)-4-oxopyridazine-3-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-keto-1-(m-tolyl)pyridazine-3-carboxamide Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N4O2S/c1-13-5-4-6-14(11-13)25-10-9-17(26)19(24-25)20(27)23-21-16(12-22)15-7-2-3-8-18(15)28-21/h4-6,9-11H,2-3,7-8H2,1H3,(H,23,27)