1-[4-(phenylmethyl)piperidin-1-yl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanone

Systemtic Name: 1-[4-(phenylmethyl)piperidin-1-yl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanone Openeye Name: 1-(4-benzyl-1-piperidyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanone CAS Name: 1-[4-(phenylmethyl)-1-piperidinyl]-2-(4-thieno[2,3-d]pyrimidinylthio)ethanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanone Traditional Name: 1-(4-benzylpiperidino)-2-(thieno[2,3-d]pyrimidin-4-ylthio)ethanone Formula: C20H21N3OS2 MolecularWeight: 383.53024

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)CSC3=NC=NC4=C3C=CS4

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)CSC3=NC=NC4=C3C=CS4

InChI

InChI=1S/C20H21N3OS2/c24-18(13-26-20-17-8-11-25-19(17)21-14-22-20)23-9-6-16(7-10-23)12-15-4-2-1-3-5-15/h1-5,8,11,14,16H,6-7,9-10,12-13H2