N-(1,3-benzodioxol-5-ylmethyl)-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(6-ethyl-4-thieno[2,3-d]pyrimidinyl)-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidine-3-carboxamide Traditional Name: 1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N-piperonyl-nipecotamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CCCC(C3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCCC(C3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H24N4O3S/c1-2-16-9-17-20(24-12-25-22(17)30-16)26-7-3-4-15(11-26)21(27)23-10-14-5-6-18-19(8-14)29-13-28-18/h5-6,8-9,12,15H,2-4,7,10-11,13H2,1H3,(H,23,27)