3-[[(5-bromanylthiophen-2-yl)methyl-methyl-amino]methyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[[(5-bromanylthiophen-2-yl)methyl-methyl-amino]methyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[[(5-bromo-2-thienyl)methyl-methyl-amino]methyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[(5-bromo-2-thiophenyl)methyl-methylamino]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[[(5-bromothiophen-2-yl)methyl-methylamino]methyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[(5-bromo-2-thienyl)methyl-methyl-amino]methyl]-1,2,3-benzotriazin-4-one Formula: C14H13BrN4OS MolecularWeight: 365.24822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(S1)Br)CN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CN(CC1=CC=C(S1)Br)CN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C14H13BrN4OS/c1-18(8-10-6-7-13(15)21-10)9-19-14(20)11-4-2-3-5-12(11)16-17-19/h2-7H,8-9H2,1H3