3-[(2Z)-2-cyano-2-(5,6-dimethyl-4-oxidanylidene-1H-thieno[2,3-d]pyrimidin-2-ylidene)ethanoyl]-N-ethyl-N-phenyl-benzenesulfonamide

Systemtic Name: 3-[(2Z)-2-cyano-2-(5,6-dimethyl-4-oxidanylidene-1H-thieno[2,3-d]pyrimidin-2-ylidene)ethanoyl]-N-ethyl-N-phenyl-benzenesulfonamide Openeye Name: 3-[(2Z)-2-cyano-2-(5,6-dimethyl-4-oxo-1H-thieno[2,3-d]pyrimidin-2-ylidene)acetyl]-N-ethyl-N-phenyl-benzenesulfonamide CAS Name: 3-[(2Z)-2-cyano-2-(5,6-dimethyl-4-oxo-1H-thieno[2,3-d]pyrimidin-2-ylidene)-1-oxoethyl]-N-ethyl-N-phenylbenzenesulfonamide IUPAC Name: 3-[(2Z)-2-cyano-2-(5,6-dimethyl-4-oxo-1H-thieno[2,3-d]pyrimidin-2-ylidene)acetyl]-N-ethyl-N-phenylbenzenesulfonamide Traditional Name: 3-[(2Z)-2-cyano-2-(4-keto-5,6-dimethyl-1H-thieno[2,3-d]pyrimidin-2-ylidene)acetyl]-N-ethyl-N-phenyl-benzenesulfonamide Formula: C25H22N4O4S2 MolecularWeight: 506.59658

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)C(=C3NC4=C(C(=C(S4)C)C)C(=O)N3)C#N

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)/C(=C/3\NC4=C(C(=C(S4)C)C)C(=O)N3)/C#N

InChI

InChI=1S/C25H22N4O4S2/c1-4-29(18-10-6-5-7-11-18)35(32,33)19-12-8-9-17(13-19)22(30)20(14-26)23-27-24(31)21-15(2)16(3)34-25(21)28-23/h5-13,28H,4H2,1-3H3,(H,27,31)/b23-20-