6,8-bis(bromanyl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 6,8-bis(bromanyl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 6,8-dibromo-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 6,8-dibromo-2-[[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 6,8-dibromo-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 6,8-dibromo-2-[[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-1H-quinazolin-4-one Formula: C17H15Br2N5OS MolecularWeight: 497.2069

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCC4=NC(=O)C5=CC(=CC(=C5N4)Br)Br

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SCC4=NC(=O)C5=CC(=CC(=C5N4)Br)Br

InChI

InChI=1S/C17H15Br2N5OS/c18-9-5-11-14(12(19)6-9)20-13(21-16(11)25)7-26-17-23-22-15(8-1-2-8)24(17)10-3-4-10/h5-6,8,10H,1-4,7H2,(H,20,21,25)