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

Systemtic Name: 6,8-bis(bromanyl)-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 6,8-dibromo-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 6,8-dibromo-2-[[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 6,8-dibromo-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 6,8-dibromo-2-[[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-1H-quinazolin-4-one Formula: C15H13Br2N5OS MolecularWeight: 471.16962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CC2)SCC3=NC(=O)C4=CC(=CC(=C4N3)Br)Br

Isomeric SMILES

CC1=NN=C(N1C2CC2)SCC3=NC(=O)C4=CC(=CC(=C4N3)Br)Br

InChI

InChI=1S/C15H13Br2N5OS/c1-7-20-21-15(22(7)9-2-3-9)24-6-12-18-13-10(14(23)19-12)4-8(16)5-11(13)17/h4-5,9H,2-3,6H2,1H3,(H,18,19,23)