N-(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(6-ethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(6-ethyl-4-keto-thieno[2,3-d]pyrimidin-3-yl)-1-(4-fluorophenyl)sulfonyl-isonipecotamide Formula: C20H21FN4O4S2 MolecularWeight: 464.533543

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H21FN4O4S2/c1-2-15-11-17-19(30-15)22-12-25(20(17)27)23-18(26)13-7-9-24(10-8-13)31(28,29)16-5-3-14(21)4-6-16/h3-6,11-13H,2,7-10H2,1H3,(H,23,26)