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

Systemtic Name: 4-(1,3-benzodioxol-5-ylamino)-N-(1-methylpiperidin-4-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(1,3-benzodioxol-5-ylamino)-N-(1-methyl-4-piperidyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-(1,3-benzodioxol-5-ylamino)-N-(1-methyl-4-piperidinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-(1,3-benzodioxol-5-ylamino)-N-(1-methylpiperidin-4-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-(1,3-benzodioxol-5-ylamino)-N-(1-methyl-4-piperidyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)NC(=O)C2=CC3=C(N=CN=C3S2)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1CCC(CC1)NC(=O)C2=CC3=C(N=CN=C3S2)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C20H21N5O3S/c1-25-6-4-12(5-7-25)24-19(26)17-9-14-18(21-10-22-20(14)29-17)23-13-2-3-15-16(8-13)28-11-27-15/h2-3,8-10,12H,4-7,11H2,1H3,(H,24,26)(H,21,22,23)