2-methoxy-5-methyl-benzo[b][1]benzothiepine-6-carbonitrile

Systemtic Name: 2-methoxy-5-methyl-benzo[b][1]benzothiepine-6-carbonitrile Openeye Name: 2-methoxy-5-methyl-benzo[b][1]benzothiepine-6-carbonitrile CAS Name: 2-methoxy-5-methyl-6-benzo[b][1]benzothiepincarbonitrile IUPAC Name: 2-methoxy-5-methylbenzo[b][1]benzothiepine-6-carbonitrile Traditional Name: 2-methoxy-5-methyl-benzo[b][1]benzothiepin-6-carbonitrile Formula: C17H13NOS MolecularWeight: 279.35622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2SC3=C1C=CC(=C3)OC)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2SC3=C1C=CC(=C3)OC)C#N

InChI

InChI=1S/C17H13NOS/c1-11-13-8-7-12(19-2)9-17(13)20-16-6-4-3-5-14(16)15(11)10-18/h3-9H,1-2H3