8,9-dimethoxy-3-methylsulfinyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine

Systemtic Name: 8,9-dimethoxy-3-methylsulfinyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Openeye Name: 8,9-dimethoxy-3-methylsulfinyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine CAS Name: 8,9-dimethoxy-3-methylsulfinyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine IUPAC Name: 8,9-dimethoxy-3-methylsulfinyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Traditional Name: 8,9-dimethoxy-3-methylsulfinyl-11H-[1,2,4]triazolo[3,4-b][3]benzazepine Formula: C14H15N3O3S MolecularWeight: 305.3522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=CN3C(=NN=C3S(=O)C)CC2=C1)OC

Isomeric SMILES

COC1=C(C=C2C=CN3C(=NN=C3S(=O)C)CC2=C1)OC

InChI

InChI=1S/C14H15N3O3S/c1-19-11-6-9-4-5-17-13(15-16-14(17)21(3)18)8-10(9)7-12(11)20-2/h4-7H,8H2,1-3H3