1-(2-diethylaminoethylamino)-4-(dimethylaminomethyl)thioxanthen-9-one

Systemtic Name: 1-(2-diethylaminoethylamino)-4-(dimethylaminomethyl)thioxanthen-9-one Openeye Name: 1-(2-diethylaminoethylamino)-4-(dimethylaminomethyl)thioxanthen-9-one CAS Name: 1-(2-diethylaminoethylamino)-4-(dimethylaminomethyl)-9-thioxanthenone IUPAC Name: 1-(2-diethylaminoethylamino)-4-(dimethylaminomethyl)thioxanthen-9-one Traditional Name: 1-(2-diethylaminoethylamino)-4-(dimethylaminomethyl)thioxanthen-9-one Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=C2C(=C(C=C1)CN(C)C)SC3=CC=CC=C3C2=O

Isomeric SMILES

CCN(CC)CCNC1=C2C(=C(C=C1)CN(C)C)SC3=CC=CC=C3C2=O

InChI

InChI=1S/C22H29N3OS/c1-5-25(6-2)14-13-23-18-12-11-16(15-24(3)4)22-20(18)21(26)17-9-7-8-10-19(17)27-22/h7-12,23H,5-6,13-15H2,1-4H3