1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-quinazolin-4-ylsulfanyl-ethanone

Systemtic Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-quinazolin-4-ylsulfanyl-ethanone Openeye Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-quinazolin-4-ylsulfanyl-ethanone CAS Name: 1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-(4-quinazolinylthio)ethanone IUPAC Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-quinazolin-4-ylsulfanylethanone Traditional Name: 1-[4-(2-pyrimidyl)piperazino]-2-(quinazolin-4-ylthio)ethanone Formula: C18H18N6OS MolecularWeight: 366.44012

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CSC3=NC=NC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CSC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C18H18N6OS/c25-16(12-26-17-14-4-1-2-5-15(14)21-13-22-17)23-8-10-24(11-9-23)18-19-6-3-7-20-18/h1-7,13H,8-12H2