8-chloranyl-5-methylsulfanyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine

Systemtic Name: 8-chloranyl-5-methylsulfanyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Openeye Name: 8-chloro-5-methylsulfanyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine CAS Name: 8-chloro-5-(methylthio)-11H-[1,2,4]triazolo[3,4-b][3]benzazepine IUPAC Name: 8-chloro-5-methylsulfanyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Traditional Name: 8-chloro-5-(methylthio)-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Formula: C12H10ClN3S MolecularWeight: 263.7459

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(CC3=NN=CN31)C=CC(=C2)Cl

Isomeric SMILES

CSC1=CC2=C(CC3=NN=CN31)C=CC(=C2)Cl

InChI

InChI=1S/C12H10ClN3S/c1-17-12-6-9-4-10(13)3-2-8(9)5-11-15-14-7-16(11)12/h2-4,6-7H,5H2,1H3