6-morpholin-4-yl-3-(phenylmethyl)-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 6-morpholin-4-yl-3-(phenylmethyl)-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 3-benzyl-6-morpholino-2-(4-pyridylmethylsulfanyl)quinazolin-4-one CAS Name: 6-(4-morpholinyl)-3-(phenylmethyl)-2-(pyridin-4-ylmethylthio)-4-quinazolinone IUPAC Name: 3-benzyl-6-morpholin-4-yl-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 3-benzyl-6-morpholino-2-(4-pyridylmethylthio)quinazolin-4-one Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC3=C(C=C2)N=C(N(C3=O)CC4=CC=CC=C4)SCC5=CC=NC=C5

Isomeric SMILES

C1COCCN1C2=CC3=C(C=C2)N=C(N(C3=O)CC4=CC=CC=C4)SCC5=CC=NC=C5

InChI

InChI=1S/C25H24N4O2S/c30-24-22-16-21(28-12-14-31-15-13-28)6-7-23(22)27-25(32-18-20-8-10-26-11-9-20)29(24)17-19-4-2-1-3-5-19/h1-11,16H,12-15,17-18H2