2-[bis(3-methylbutyl)amino]-1-phenoxathiin-2-yl-ethanol

Systemtic Name: 2-[bis(3-methylbutyl)amino]-1-phenoxathiin-2-yl-ethanol Openeye Name: 2-(diisopentylamino)-1-phenoxathiin-2-yl-ethanol CAS Name: 2-[bis(3-methylbutyl)amino]-1-(2-phenoxathiinyl)ethanol IUPAC Name: 2-[bis(3-methylbutyl)amino]-1-phenoxathiin-2-ylethanol Traditional Name: 2-(diisoamylamino)-1-phenoxathiin-2-yl-ethanol Formula: C24H33NO2S MolecularWeight: 399.58932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CCC(C)C)CC(C1=CC2=C(C=C1)OC3=CC=CC=C3S2)O

Isomeric SMILES

CC(C)CCN(CCC(C)C)CC(C1=CC2=C(C=C1)OC3=CC=CC=C3S2)O

InChI

InChI=1S/C24H33NO2S/c1-17(2)11-13-25(14-12-18(3)4)16-20(26)19-9-10-22-24(15-19)28-23-8-6-5-7-21(23)27-22/h5-10,15,17-18,20,26H,11-14,16H2,1-4H3