azepan-1-yl(4,5-dihydrobenzo[g][1]benzothiol-2-yl)methanone

Systemtic Name: azepan-1-yl(4,5-dihydrobenzo[g][1]benzothiol-2-yl)methanone Openeye Name: azepan-1-yl(4,5-dihydrobenzo[g]benzothiophen-2-yl)methanone CAS Name: 1-azepanyl(4,5-dihydrobenzo[g][1]benzothiol-2-yl)methanone IUPAC Name: azepan-1-yl(4,5-dihydrobenzo[g][1]benzothiol-2-yl)methanone Traditional Name: azepan-1-yl(4,5-dihydrobenzo[g]benzothiophen-2-yl)methanone Formula: C19H21NOS MolecularWeight: 311.44114

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3

InChI

InChI=1S/C19H21NOS/c21-19(20-11-5-1-2-6-12-20)17-13-15-10-9-14-7-3-4-8-16(14)18(15)22-17/h3-4,7-8,13H,1-2,5-6,9-12H2