5-methyl-3-methylsulfonyl-11-phenyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine

Systemtic Name: 5-methyl-3-methylsulfonyl-11-phenyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Openeye Name: 5-methyl-3-methylsulfonyl-11-phenyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine CAS Name: 5-methyl-3-methylsulfonyl-11-phenyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine IUPAC Name: 5-methyl-3-methylsulfonyl-11-phenyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Traditional Name: 3-mesyl-5-methyl-11-phenyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C(C3=NN=C(N13)S(=O)(=O)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=CC=CC=C2C(C3=NN=C(N13)S(=O)(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C19H17N3O2S/c1-13-12-15-10-6-7-11-16(15)17(14-8-4-3-5-9-14)18-20-21-19(22(13)18)25(2,23)24/h3-12,17H,1-2H3