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

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

C1CC(CN(C1)C(=O)CSC2=NC=NC3=C2C=CS3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC(CN(C1)C(=O)CSC2=NC=NC3=C2C=CS3)C4=NC5=CC=CC=C5S4

InChI

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