2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]-sulfanyl-methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]-sulfanyl-methyl]-1H-quinazolin-4-one Openeye Name: 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)-sulfanyl-methyl]-1H-quinazolin-4-one CAS Name: 2-[mercapto-[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)-sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)-mercapto-methyl]-1H-quinazolin-4-one Formula: C18H14N4O2S MolecularWeight: 350.39436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(O2)C(C3=NC(=O)C4=CC=CC=C4N3)S

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(O2)C(C3=NC(=O)C4=CC=CC=C4N3)S

InChI

InChI=1S/C18H14N4O2S/c23-17-12-8-4-5-9-13(12)19-16(20-17)15(25)18-22-21-14(24-18)10-11-6-2-1-3-7-11/h1-9,15,25H,10H2,(H,19,20,23)