3-ethylsulfanyl-[1,2,4]triazolo[3,4-b][3]benzazepin-11-one

Systemtic Name: 3-ethylsulfanyl-[1,2,4]triazolo[3,4-b][3]benzazepin-11-one Openeye Name: 3-ethylsulfanyl-[1,2,4]triazolo[3,4-b][3]benzazepin-11-one CAS Name: 3-(ethylthio)-[1,2,4]triazolo[3,4-b][3]benzazepin-11-one IUPAC Name: 3-ethylsulfanyl-[1,2,4]triazolo[3,4-b][3]benzazepin-11-one Traditional Name: 3-(ethylthio)-[1,2,4]triazolo[3,4-b][3]benzazepin-11-one Formula: C13H11N3OS MolecularWeight: 257.31094

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C2N1C=CC3=CC=CC=C3C2=O

Isomeric SMILES

CCSC1=NN=C2N1C=CC3=CC=CC=C3C2=O

InChI

InChI=1S/C13H11N3OS/c1-2-18-13-15-14-12-11(17)10-6-4-3-5-9(10)7-8-16(12)13/h3-8H,2H2,1H3