5-azanyl-1-(2-diethylaminoethylamino)-4-methyl-thioxanthen-9-one

Systemtic Name: 5-azanyl-1-(2-diethylaminoethylamino)-4-methyl-thioxanthen-9-one Openeye Name: 5-amino-1-(2-diethylaminoethylamino)-4-methyl-thioxanthen-9-one CAS Name: 5-amino-1-(2-diethylaminoethylamino)-4-methyl-9-thioxanthenone IUPAC Name: 5-amino-1-(2-diethylaminoethylamino)-4-methylthioxanthen-9-one Traditional Name: 5-amino-1-(2-diethylaminoethylamino)-4-methyl-thioxanthen-9-one Formula: C20H25N3OS MolecularWeight: 355.497

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=C2C(=C(C=C1)C)SC3=C(C2=O)C=CC=C3N

Isomeric SMILES

CCN(CC)CCNC1=C2C(=C(C=C1)C)SC3=C(C2=O)C=CC=C3N

InChI

InChI=1S/C20H25N3OS/c1-4-23(5-2)12-11-22-16-10-9-13(3)19-17(16)18(24)14-7-6-8-15(21)20(14)25-19/h6-10,22H,4-5,11-12,21H2,1-3H3