10-bromanyl-6-methyl-3-methylsulfanyl-[1,2,4]triazino[5,6-d][3,1]benzoxazepine

Systemtic Name: 10-bromanyl-6-methyl-3-methylsulfanyl-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Openeye Name: 10-bromo-6-methyl-3-methylsulfanyl-[1,2,4]triazino[5,6-d][3,1]benzoxazepine CAS Name: 10-bromo-6-methyl-3-(methylthio)-[1,2,4]triazino[5,6-d][3,1]benzoxazepine IUPAC Name: 10-bromo-6-methyl-3-methylsulfanyl-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Traditional Name: 10-bromo-6-methyl-3-(methylthio)-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Formula: C12H9BrN4OS MolecularWeight: 337.19506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)Br)C3=C(O1)N=C(N=N3)SC

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)Br)C3=C(O1)N=C(N=N3)SC

InChI

InChI=1S/C12H9BrN4OS/c1-6-14-9-4-3-7(13)5-8(9)10-11(18-6)15-12(19-2)17-16-10/h3-5H,1-2H3