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

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-oxidanylidene-1-phenyl-pyridazine-3-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-oxo-1-phenyl-pyridazine-3-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-oxo-1-phenyl-3-pyridazinecarboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-oxo-1-phenylpyridazine-3-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-keto-1-phenyl-pyridazine-3-carboxamide Formula: C20H16N4O2S MolecularWeight: 376.43164

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=NN(C=CC3=O)C4=CC=CC=C4)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=NN(C=CC3=O)C4=CC=CC=C4)C#N

InChI

InChI=1S/C20H16N4O2S/c21-12-15-14-8-4-5-9-17(14)27-20(15)22-19(26)18-16(25)10-11-24(23-18)13-6-2-1-3-7-13/h1-3,6-7,10-11H,4-5,8-9H2,(H,22,26)