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

Systemtic Name: 4-azanyl-5-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-6-oxidanylidene-1-phenyl-pyridazine-3-carboxamide Openeye Name: 4-amino-5-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-6-oxo-1-phenyl-pyridazine-3-carboxamide CAS Name: 4-amino-5-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-6-oxo-1-phenyl-3-pyridazinecarboxamide IUPAC Name: 4-amino-5-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-6-oxo-1-phenylpyridazine-3-carboxamide Traditional Name: 4-amino-5-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-6-keto-1-phenyl-pyridazine-3-carboxamide Formula: C21H16N6O2S MolecularWeight: 416.45574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=NN(C(=O)C(=C3N)C#N)C4=CC=CC=C4)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=NN(C(=O)C(=C3N)C#N)C4=CC=CC=C4)C#N

InChI

InChI=1S/C21H16N6O2S/c22-10-14-13-8-4-5-9-16(13)30-20(14)25-19(28)18-17(24)15(11-23)21(29)27(26-18)12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-9,24H2,(H,25,28)