6,8-bis(bromanyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 6,8-bis(bromanyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 6,8-dibromo-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 6,8-dibromo-2-[[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 6,8-dibromo-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 6,8-dibromo-2-[[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-1H-quinazolin-4-one Formula: C14H11Br2N5OS MolecularWeight: 457.14304

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=NN=C2SCC3=NC(=O)C4=CC(=CC(=C4N3)Br)Br

Isomeric SMILES

C1CC1N2C=NN=C2SCC3=NC(=O)C4=CC(=CC(=C4N3)Br)Br

InChI

InChI=1S/C14H11Br2N5OS/c15-7-3-9-12(10(16)4-7)18-11(19-13(9)22)5-23-14-20-17-6-21(14)8-1-2-8/h3-4,6,8H,1-2,5H2,(H,18,19,22)