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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-5-methyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-5-methyl-4-(2-methyl-1-piperidyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-5-methyl-4-(2-methyl-1-piperidinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-5-methyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-5-methyl-4-(2-methylpiperidino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=C3C(=C(SC3=NC=N2)C(=O)NC4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CC1CCCCN1C2=C3C(=C(SC3=NC=N2)C(=O)NC4=CC5=C(C=C4)OCO5)C

InChI

InChI=1S/C21H22N4O3S/c1-12-5-3-4-8-25(12)19-17-13(2)18(29-21(17)23-10-22-19)20(26)24-14-6-7-15-16(9-14)28-11-27-15/h6-7,9-10,12H,3-5,8,11H2,1-2H3,(H,24,26)