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

Systemtic Name: 3-propan-2-ylsulfanyl-[1,2,4]triazolo[3,4-b][3]benzazepin-11-one Openeye Name: 3-isopropylsulfanyl-[1,2,4]triazolo[3,4-b][3]benzazepin-11-one CAS Name: 3-(propan-2-ylthio)-[1,2,4]triazolo[3,4-b][3]benzazepin-11-one IUPAC Name: 3-propan-2-ylsulfanyl-[1,2,4]triazolo[3,4-b][3]benzazepin-11-one Traditional Name: 3-(isopropylthio)-[1,2,4]triazolo[3,4-b][3]benzazepin-11-one Formula: C14H13N3OS MolecularWeight: 271.33752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NN=C2N1C=CC3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)SC1=NN=C2N1C=CC3=CC=CC=C3C2=O

InChI

InChI=1S/C14H13N3OS/c1-9(2)19-14-16-15-13-12(18)11-6-4-3-5-10(11)7-8-17(13)14/h3-9H,1-2H3