1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-1,4-diazepane

Systemtic Name: 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-1,4-diazepane Openeye Name: 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-1,4-diazepane CAS Name: 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-1,4-diazepane IUPAC Name: 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-1,4-diazepane Traditional Name: 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-1,4-diazepane Formula: C20H24N2S MolecularWeight: 324.48296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2CC3=CC=CC=C3SC4=CC=CC=C24

Isomeric SMILES

CN1CCCN(CC1)C2CC3=CC=CC=C3SC4=CC=CC=C24

InChI

InChI=1S/C20H24N2S/c1-21-11-6-12-22(14-13-21)18-15-16-7-2-4-9-19(16)23-20-10-5-3-8-17(18)20/h2-5,7-10,18H,6,11-15H2,1H3