3-methylsulfanyl-11-propan-2-yl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine

Systemtic Name: 3-methylsulfanyl-11-propan-2-yl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Openeye Name: 11-isopropyl-3-methylsulfanyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine CAS Name: 3-(methylthio)-11-propan-2-yl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine IUPAC Name: 3-methylsulfanyl-11-propan-2-yl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Traditional Name: 11-isopropyl-3-(methylthio)-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Formula: C15H17N3S MolecularWeight: 271.38058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C2=CC=CC=C2C=CN3C1=NN=C3SC

Isomeric SMILES

CC(C)C1C2=CC=CC=C2C=CN3C1=NN=C3SC

InChI

InChI=1S/C15H17N3S/c1-10(2)13-12-7-5-4-6-11(12)8-9-18-14(13)16-17-15(18)19-3/h4-10,13H,1-3H3