9-methoxy-11-methylidene-3-methylsulfonyl-[1,2,4]triazolo[3,4-b][3]benzazepine

Systemtic Name: 9-methoxy-11-methylidene-3-methylsulfonyl-[1,2,4]triazolo[3,4-b][3]benzazepine Openeye Name: 9-methoxy-11-methylene-3-methylsulfonyl-[1,2,4]triazolo[3,4-b][3]benzazepine CAS Name: 9-methoxy-11-methylene-3-methylsulfonyl-[1,2,4]triazolo[3,4-b][3]benzazepine IUPAC Name: 9-methoxy-11-methylidene-3-methylsulfonyl-[1,2,4]triazolo[3,4-b][3]benzazepine Traditional Name: 3-mesyl-9-methoxy-11-methylene-[1,2,4]triazolo[3,4-b][3]benzazepine Formula: C14H13N3O3S MolecularWeight: 303.33632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=CN3C(=NN=C3S(=O)(=O)C)C2=C

Isomeric SMILES

COC1=CC2=C(C=C1)C=CN3C(=NN=C3S(=O)(=O)C)C2=C

InChI

InChI=1S/C14H13N3O3S/c1-9-12-8-11(20-2)5-4-10(12)6-7-17-13(9)15-16-14(17)21(3,18)19/h4-8H,1H2,2-3H3