1-ethyl-N-(2-methoxyethyl)-4-(4-oxidanylidene-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-3-yl)pyrazole-3-carboxamide

Systemtic Name: 1-ethyl-N-(2-methoxyethyl)-4-(4-oxidanylidene-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-3-yl)pyrazole-3-carboxamide Openeye Name: 1-ethyl-N-(2-methoxyethyl)-4-(4-oxo-6-phenyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-3-yl)pyrazole-3-carboxamide CAS Name: 1-ethyl-N-(2-methoxyethyl)-4-(4-oxo-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-3-yl)-3-pyrazolecarboxamide IUPAC Name: 1-ethyl-N-(2-methoxyethyl)-4-(4-oxo-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-3-yl)pyrazole-3-carboxamide Traditional Name: 1-ethyl-4-(4-keto-6-phenyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-3-yl)-N-(2-methoxyethyl)pyrazole-3-carboxamide Formula: C21H21N5O3S2 MolecularWeight: 455.55314

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NCCOC)N2C(=O)C3=C(NC2=S)SC(=C3)C4=CC=CC=C4

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NCCOC)N2C(=O)C3=C(NC2=S)SC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5O3S2/c1-3-25-12-15(17(24-25)18(27)22-9-10-29-2)26-20(28)14-11-16(13-7-5-4-6-8-13)31-19(14)23-21(26)30/h4-8,11-12H,3,9-10H2,1-2H3,(H,22,27)(H,23,30)