1-azanyl-2-[3-(diethylamino)propyl]-4-(hydroxymethyl)thioxanthen-9-one

Systemtic Name: 1-azanyl-2-[3-(diethylamino)propyl]-4-(hydroxymethyl)thioxanthen-9-one Openeye Name: 1-amino-2-[3-(diethylamino)propyl]-4-(hydroxymethyl)thioxanthen-9-one CAS Name: 1-amino-2-[3-(diethylamino)propyl]-4-(hydroxymethyl)-9-thioxanthenone IUPAC Name: 1-amino-2-[3-(diethylamino)propyl]-4-(hydroxymethyl)thioxanthen-9-one Traditional Name: 1-amino-2-[3-(diethylamino)propyl]-4-methylol-thioxanthen-9-one Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC1=CC(=C2C(=C1N)C(=O)C3=CC=CC=C3S2)CO

Isomeric SMILES

CCN(CC)CCCC1=CC(=C2C(=C1N)C(=O)C3=CC=CC=C3S2)CO

InChI

InChI=1S/C21H26N2O2S/c1-3-23(4-2)11-7-8-14-12-15(13-24)21-18(19(14)22)20(25)16-9-5-6-10-17(16)26-21/h5-6,9-10,12,24H,3-4,7-8,11,13,22H2,1-2H3