N-(1,3-benzodioxol-5-yl)-5-methyl-4-oxidanylidene-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-5-methyl-4-oxidanylidene-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-5-methyl-4-oxo-3-[2-oxo-2-(1-piperidyl)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-5-methyl-4-oxo-3-[2-oxo-2-(1-piperidinyl)ethyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-5-methyl-4-oxo-3-(2-oxo-2-piperidin-1-ylethyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-keto-3-(2-keto-2-piperidino-ethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)N3CCCCC3)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)N3CCCCC3)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H22N4O5S/c1-13-18-21(23-11-26(22(18)29)10-17(27)25-7-3-2-4-8-25)32-19(13)20(28)24-14-5-6-15-16(9-14)31-12-30-15/h5-6,9,11H,2-4,7-8,10,12H2,1H3,(H,24,28)