N-(1,3-benzodioxol-5-yl)-1-(3,5-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-6-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-(3,5-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-6-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(3,5-dimethyl-4-oxo-thieno[2,3-d]pyrimidine-6-carbonyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(3,5-dimethyl-4-oxo-6-thieno[2,3-d]pyrimidinyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(3,5-dimethyl-4-oxothieno[2,3-d]pyrimidine-6-carbonyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(4-keto-3,5-dimethyl-thieno[2,3-d]pyrimidine-6-carbonyl)isonipecotamide Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)N3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)N3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H22N4O5S/c1-12-17-20(23-10-25(2)21(17)28)32-18(12)22(29)26-7-5-13(6-8-26)19(27)24-14-3-4-15-16(9-14)31-11-30-15/h3-4,9-10,13H,5-8,11H2,1-2H3,(H,24,27)