1-[2-(2-hydroxyethylamino)ethylamino]-4-methyl-7-oxidanyl-thioxanthen-9-one

Systemtic Name: 1-[2-(2-hydroxyethylamino)ethylamino]-4-methyl-7-oxidanyl-thioxanthen-9-one Openeye Name: 7-hydroxy-1-[2-(2-hydroxyethylamino)ethylamino]-4-methyl-thioxanthen-9-one CAS Name: 7-hydroxy-1-[2-(2-hydroxyethylamino)ethylamino]-4-methyl-9-thioxanthenone IUPAC Name: 7-hydroxy-1-[2-(2-hydroxyethylamino)ethylamino]-4-methylthioxanthen-9-one Traditional Name: 7-hydroxy-1-[2-(2-hydroxyethylamino)ethylamino]-4-methyl-thioxanthen-9-one Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)NCCNCCO)C(=O)C3=C(S2)C=CC(=C3)O

Isomeric SMILES

CC1=C2C(=C(C=C1)NCCNCCO)C(=O)C3=C(S2)C=CC(=C3)O

InChI

InChI=1S/C18H20N2O3S/c1-11-2-4-14(20-7-6-19-8-9-21)16-17(23)13-10-12(22)3-5-15(13)24-18(11)16/h2-5,10,19-22H,6-9H2,1H3