1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-quinazolin-4-ylsulfanyl-ethanone

Systemtic Name: 1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-quinazolin-4-ylsulfanyl-ethanone Openeye Name: 1-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-quinazolin-4-ylsulfanyl-ethanone CAS Name: 1-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-(4-quinazolinylthio)ethanone IUPAC Name: 1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-quinazolin-4-ylsulfanylethanone Traditional Name: 1-[4-(1,3-benzothiazol-2-yl)piperidino]-2-(quinazolin-4-ylthio)ethanone Formula: C22H20N4OS2 MolecularWeight: 420.5504

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CSC4=NC=NC5=CC=CC=C54

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CSC4=NC=NC5=CC=CC=C54

InChI

InChI=1S/C22H20N4OS2/c27-20(13-28-22-16-5-1-2-6-17(16)23-14-24-22)26-11-9-15(10-12-26)21-25-18-7-3-4-8-19(18)29-21/h1-8,14-15H,9-13H2