10-bromanyl-2-ethylsulfanyl-5-methylidene-[1,2,4]triazolo[1,5-d][1,4]benzoxazepine

Systemtic Name: 10-bromanyl-2-ethylsulfanyl-5-methylidene-[1,2,4]triazolo[1,5-d][1,4]benzoxazepine Openeye Name: 10-bromo-2-ethylsulfanyl-5-methylene-[1,2,4]triazolo[1,5-d][1,4]benzoxazepine CAS Name: 10-bromo-2-(ethylthio)-5-methylene-[1,2,4]triazolo[1,5-d][1,4]benzoxazepine IUPAC Name: 10-bromo-2-ethylsulfanyl-5-methylidene-[1,2,4]triazolo[1,5-d][1,4]benzoxazepine Traditional Name: 10-bromo-2-(ethylthio)-5-methylene-[1,2,4]triazolo[1,5-d][1,4]benzoxazepine Formula: C13H12BrN3OS MolecularWeight: 338.22288

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN2C(=C)COC3=C(C2=N1)C=C(C=C3)Br

Isomeric SMILES

CCSC1=NN2C(=C)COC3=C(C2=N1)C=C(C=C3)Br

InChI

InChI=1S/C13H12BrN3OS/c1-3-19-13-15-12-10-6-9(14)4-5-11(10)18-7-8(2)17(12)16-13/h4-6H,2-3,7H2,1H3