3-[2-[di(propan-2-yl)amino]ethyl]-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-[2-[di(propan-2-yl)amino]ethyl]-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 3-[2-(diisopropylamino)ethyl]-2-(4-pyridylmethylsulfanyl)quinazolin-4-one CAS Name: 3-[2-[di(propan-2-yl)amino]ethyl]-2-(pyridin-4-ylmethylthio)-4-quinazolinone IUPAC Name: 3-[2-[di(propan-2-yl)amino]ethyl]-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 3-[2-(diisopropylamino)ethyl]-2-(4-pyridylmethylthio)quinazolin-4-one Formula: C22H28N4OS MolecularWeight: 396.54892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=NC=C3)C(C)C

Isomeric SMILES

CC(C)N(CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=NC=C3)C(C)C

InChI

InChI=1S/C22H28N4OS/c1-16(2)25(17(3)4)13-14-26-21(27)19-7-5-6-8-20(19)24-22(26)28-15-18-9-11-23-12-10-18/h5-12,16-17H,13-15H2,1-4H3