2-ethylsulfanyl-5-methyl-[1,2,4]triazolo[1,5-d][1,4]benzoxazepine

Systemtic Name: 2-ethylsulfanyl-5-methyl-[1,2,4]triazolo[1,5-d][1,4]benzoxazepine Openeye Name: 2-ethylsulfanyl-5-methyl-[1,2,4]triazolo[1,5-d][1,4]benzoxazepine CAS Name: 2-(ethylthio)-5-methyl-[1,2,4]triazolo[1,5-d][1,4]benzoxazepine IUPAC Name: 2-ethylsulfanyl-5-methyl-[1,2,4]triazolo[1,5-d][1,4]benzoxazepine Traditional Name: 2-(ethylthio)-5-methyl-[1,2,4]triazolo[1,5-d][1,4]benzoxazepine Formula: C13H13N3OS MolecularWeight: 259.32682

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN2C(=COC3=CC=CC=C3C2=N1)C

Isomeric SMILES

CCSC1=NN2C(=COC3=CC=CC=C3C2=N1)C

InChI

InChI=1S/C13H13N3OS/c1-3-18-13-14-12-10-6-4-5-7-11(10)17-8-9(2)16(12)15-13/h4-8H,3H2,1-2H3