N-[2-(azepan-1-yl)ethyl]-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidine-3-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidine-3-carboxamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidine-3-carboxamide CAS Name: N-[2-(1-azepanyl)ethyl]-1-(6-ethyl-4-thieno[2,3-d]pyrimidinyl)-3-piperidinecarboxamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidine-3-carboxamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)nipecotamide Formula: C22H33N5OS MolecularWeight: 415.59532

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CCCC(C3)C(=O)NCCN4CCCCCC4

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCCC(C3)C(=O)NCCN4CCCCCC4

InChI

InChI=1S/C22H33N5OS/c1-2-18-14-19-20(24-16-25-22(19)29-18)27-12-7-8-17(15-27)21(28)23-9-13-26-10-5-3-4-6-11-26/h14,16-17H,2-13,15H2,1H3,(H,23,28)