6-bromanyl-3-[5-(oxiran-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-phenyl-quinazolin-4-one

Systemtic Name: 6-bromanyl-3-[5-(oxiran-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-phenyl-quinazolin-4-one Openeye Name: 6-bromo-3-[5-(oxiran-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-phenyl-quinazolin-4-one CAS Name: 6-bromo-3-[5-(2-oxiranylmethylthio)-1,3,4-thiadiazol-2-yl]-2-phenyl-4-quinazolinone IUPAC Name: 6-bromo-3-[5-(oxiran-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-phenylquinazolin-4-one Traditional Name: 6-bromo-3-[5-(glycidylthio)-1,3,4-thiadiazol-2-yl]-2-phenyl-quinazolin-4-one Formula: C19H13BrN4O2S2 MolecularWeight: 473.36612

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Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)CSC2=NN=C(S2)N3C(=NC4=C(C3=O)C=C(C=C4)Br)C5=CC=CC=C5

Isomeric SMILES

C1C(O1)CSC2=NN=C(S2)N3C(=NC4=C(C3=O)C=C(C=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C19H13BrN4O2S2/c20-12-6-7-15-14(8-12)17(25)24(16(21-15)11-4-2-1-3-5-11)18-22-23-19(28-18)27-10-13-9-26-13/h1-8,13H,9-10H2