8-methoxy-3-methylsulfanyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine

Systemtic Name: 8-methoxy-3-methylsulfanyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Openeye Name: 8-methoxy-3-methylsulfanyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine CAS Name: 8-methoxy-3-(methylthio)-11H-[1,2,4]triazolo[3,4-b][3]benzazepine IUPAC Name: 8-methoxy-3-methylsulfanyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Traditional Name: 8-methoxy-3-(methylthio)-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Formula: C13H13N3OS MolecularWeight: 259.32682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CC3=NN=C(N3C=C2)SC)C=C1

Isomeric SMILES

COC1=CC2=C(CC3=NN=C(N3C=C2)SC)C=C1

InChI

InChI=1S/C13H13N3OS/c1-17-11-4-3-9-8-12-14-15-13(18-2)16(12)6-5-10(9)7-11/h3-7H,8H2,1-2H3