2,4-bis(bromanyl)-1-(2-diethylaminoethylamino)thioxanthen-9-one

Systemtic Name: 2,4-bis(bromanyl)-1-(2-diethylaminoethylamino)thioxanthen-9-one Openeye Name: 2,4-dibromo-1-(2-diethylaminoethylamino)thioxanthen-9-one CAS Name: 2,4-dibromo-1-(2-diethylaminoethylamino)-9-thioxanthenone IUPAC Name: 2,4-dibromo-1-(2-diethylaminoethylamino)thioxanthen-9-one Traditional Name: 2,4-dibromo-1-(2-diethylaminoethylamino)thioxanthen-9-one Formula: C19H20Br2N2OS MolecularWeight: 484.2479

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=C2C(=C(C=C1Br)Br)SC3=CC=CC=C3C2=O

Isomeric SMILES

CCN(CC)CCNC1=C2C(=C(C=C1Br)Br)SC3=CC=CC=C3C2=O

InChI

InChI=1S/C19H20Br2N2OS/c1-3-23(4-2)10-9-22-17-13(20)11-14(21)19-16(17)18(24)12-7-5-6-8-15(12)25-19/h5-8,11,22H,3-4,9-10H2,1-2H3