1-(2-dimethylaminoethylamino)-4-methyl-7-oxidanyl-thioxanthen-9-one

Systemtic Name: 1-(2-dimethylaminoethylamino)-4-methyl-7-oxidanyl-thioxanthen-9-one Openeye Name: 1-(2-dimethylaminoethylamino)-7-hydroxy-4-methyl-thioxanthen-9-one CAS Name: 1-(2-dimethylaminoethylamino)-7-hydroxy-4-methyl-9-thioxanthenone IUPAC Name: 1-(2-dimethylaminoethylamino)-7-hydroxy-4-methylthioxanthen-9-one Traditional Name: 1-(2-dimethylaminoethylamino)-7-hydroxy-4-methyl-thioxanthen-9-one Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O2S/c1-11-4-6-14(19-8-9-20(2)3)16-17(22)13-10-12(21)5-7-15(13)23-18(11)16/h4-7,10,19,21H,8-9H2,1-3H3