2-(1,3-benzoxazol-2-ylmethylsulfanyl)-3-pyridin-3-yl-quinazolin-4-one

Systemtic Name: 2-(1,3-benzoxazol-2-ylmethylsulfanyl)-3-pyridin-3-yl-quinazolin-4-one Openeye Name: 2-(1,3-benzoxazol-2-ylmethylsulfanyl)-3-(3-pyridyl)quinazolin-4-one CAS Name: 2-(1,3-benzoxazol-2-ylmethylthio)-3-(3-pyridinyl)-4-quinazolinone IUPAC Name: 2-(1,3-benzoxazol-2-ylmethylsulfanyl)-3-pyridin-3-ylquinazolin-4-one Traditional Name: 2-(1,3-benzoxazol-2-ylmethylthio)-3-(3-pyridyl)quinazolin-4-one Formula: C21H14N4O2S MolecularWeight: 386.42646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NC4=CC=CC=C4O3)C5=CN=CC=C5

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NC4=CC=CC=C4O3)C5=CN=CC=C5

InChI

InChI=1S/C21H14N4O2S/c26-20-15-7-1-2-8-16(15)24-21(25(20)14-6-5-11-22-12-14)28-13-19-23-17-9-3-4-10-18(17)27-19/h1-12H,13H2