N-(2-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-(2-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-keto-2-methyl-thieno[2,3-d]pyrimidin-3-yl)-1-tosyl-isonipecotamide Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NN3C(=NC4=C(C3=O)C=CS4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NN3C(=NC4=C(C3=O)C=CS4)C

InChI

InChI=1S/C20H22N4O4S2/c1-13-3-5-16(6-4-13)30(27,28)23-10-7-15(8-11-23)18(25)22-24-14(2)21-19-17(20(24)26)9-12-29-19/h3-6,9,12,15H,7-8,10-11H2,1-2H3,(H,22,25)