3-[(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(6-bromo-3-ethyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[(6-bromo-3-ethyl-4-oxo-2-quinazolinyl)thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(6-bromo-3-ethyl-4-oxoquinazolin-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[(6-bromo-3-ethyl-4-keto-quinazolin-2-yl)thio]methyl]-1,2,3-benzotriazin-4-one Formula: C18H14BrN5O2S MolecularWeight: 444.30506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C18H14BrN5O2S/c1-2-23-16(25)13-9-11(19)7-8-14(13)20-18(23)27-10-24-17(26)12-5-3-4-6-15(12)21-22-24/h3-9H,2,10H2,1H3