1-[2-(2-ethylpiperidin-1-yl)ethylamino]-4-(hydroxymethyl)thioxanthen-9-one

Systemtic Name: 1-[2-(2-ethylpiperidin-1-yl)ethylamino]-4-(hydroxymethyl)thioxanthen-9-one Openeye Name: 1-[2-(2-ethyl-1-piperidyl)ethylamino]-4-(hydroxymethyl)thioxanthen-9-one CAS Name: 1-[2-(2-ethyl-1-piperidinyl)ethylamino]-4-(hydroxymethyl)-9-thioxanthenone IUPAC Name: 1-[2-(2-ethylpiperidin-1-yl)ethylamino]-4-(hydroxymethyl)thioxanthen-9-one Traditional Name: 1-[2-(2-ethylpiperidino)ethylamino]-4-methylol-thioxanthen-9-one Formula: C23H28N2O2S MolecularWeight: 396.54562

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1CCNC2=C3C(=C(C=C2)CO)SC4=CC=CC=C4C3=O

Isomeric SMILES

CCC1CCCCN1CCNC2=C3C(=C(C=C2)CO)SC4=CC=CC=C4C3=O

InChI

InChI=1S/C23H28N2O2S/c1-2-17-7-5-6-13-25(17)14-12-24-19-11-10-16(15-26)23-21(19)22(27)18-8-3-4-9-20(18)28-23/h3-4,8-11,17,24,26H,2,5-7,12-15H2,1H3