1-(8-bromanylbenzo[e][1]benzothiol-4-yl)-2-(dibutylamino)ethanol

Systemtic Name: 1-(8-bromanylbenzo[e][1]benzothiol-4-yl)-2-(dibutylamino)ethanol Openeye Name: 1-(8-bromobenzo[e]benzothiophen-4-yl)-2-(dibutylamino)ethanol CAS Name: 1-(8-bromo-4-benzo[e][1]benzothiolyl)-2-(dibutylamino)ethanol IUPAC Name: 1-(8-bromobenzo[e][1]benzothiol-4-yl)-2-(dibutylamino)ethanol Traditional Name: 1-(8-bromobenzo[e]benzothiophen-4-yl)-2-(dibutylamino)ethanol Formula: C22H28BrNOS MolecularWeight: 434.43282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CC(C1=C2C(=C3C=C(C=CC3=C1)Br)C=CS2)O

Isomeric SMILES

CCCCN(CCCC)CC(C1=C2C(=C3C=C(C=CC3=C1)Br)C=CS2)O

InChI

InChI=1S/C22H28BrNOS/c1-3-5-10-24(11-6-4-2)15-21(25)20-13-16-7-8-17(23)14-19(16)18-9-12-26-22(18)20/h7-9,12-14,21,25H,3-6,10-11,15H2,1-2H3