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

Systemtic Name: 1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanone Openeye Name: 1-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanone CAS Name: 1-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-(4-thieno[2,3-d]pyrimidinylthio)ethanone IUPAC Name: 1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanone Traditional Name: 1-[4-(1,3-benzothiazol-2-yl)piperidino]-2-(thieno[2,3-d]pyrimidin-4-ylthio)ethanone Formula: C20H18N4OS3 MolecularWeight: 426.57812

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CSC4=NC=NC5=C4C=CS5

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CSC4=NC=NC5=C4C=CS5

InChI

InChI=1S/C20H18N4OS3/c25-17(11-27-20-14-7-10-26-19(14)21-12-22-20)24-8-5-13(6-9-24)18-23-15-3-1-2-4-16(15)28-18/h1-4,7,10,12-13H,5-6,8-9,11H2