7-chloranyl-2-methylsulfanyl-5-phenyl-4H-1,3,4-benzotriazepine

Systemtic Name: 7-chloranyl-2-methylsulfanyl-5-phenyl-4H-1,3,4-benzotriazepine Openeye Name: 7-chloro-2-methylsulfanyl-5-phenyl-4H-1,3,4-benzotriazepine CAS Name: 7-chloro-2-(methylthio)-5-phenyl-4H-1,3,4-benzotriazepine IUPAC Name: 7-chloro-2-methylsulfanyl-5-phenyl-4H-1,3,4-benzotriazepine Traditional Name: 7-chloro-2-(methylthio)-5-phenyl-4H-1,3,4-benzotriazepine Formula: C15H12ClN3S MolecularWeight: 301.79388

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NNC(=C2C=C(C=CC2=N1)Cl)C3=CC=CC=C3

Isomeric SMILES

CSC1=NNC(=C2C=C(C=CC2=N1)Cl)C3=CC=CC=C3

InChI

InChI=1S/C15H12ClN3S/c1-20-15-17-13-8-7-11(16)9-12(13)14(18-19-15)10-5-3-2-4-6-10/h2-9,18H,1H3