1-benzo[b][1]benzothiepin-5-yl-4-methyl-1,4-diazepane

Systemtic Name: 1-benzo[b][1]benzothiepin-5-yl-4-methyl-1,4-diazepane Openeye Name: 1-benzo[b][1]benzothiepin-5-yl-4-methyl-1,4-diazepane CAS Name: 1-(5-benzo[b][1]benzothiepinyl)-4-methyl-1,4-diazepane IUPAC Name: 1-benzo[b][1]benzothiepin-5-yl-4-methyl-1,4-diazepane Traditional Name: 1-benzo[b][1]benzothiepin-5-yl-4-methyl-1,4-diazepane Formula: C20H22N2S MolecularWeight: 322.46708

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2=CC3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

CN1CCCN(CC1)C2=CC3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C20H22N2S/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/h2-5,7-10,15H,6,11-14H2,1H3