4-(3-azanylpropylamino)-1-(2-dimethylaminoethylamino)thioxanthen-9-one

Systemtic Name: 4-(3-azanylpropylamino)-1-(2-dimethylaminoethylamino)thioxanthen-9-one Openeye Name: 4-(3-aminopropylamino)-1-(2-dimethylaminoethylamino)thioxanthen-9-one CAS Name: 4-(3-aminopropylamino)-1-(2-dimethylaminoethylamino)-9-thioxanthenone IUPAC Name: 4-(3-aminopropylamino)-1-(2-dimethylaminoethylamino)thioxanthen-9-one Traditional Name: 4-(3-aminopropylamino)-1-(2-dimethylaminoethylamino)thioxanthen-9-one Formula: C20H26N4OS MolecularWeight: 370.51164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4OS/c1-24(2)13-12-23-15-8-9-16(22-11-5-10-21)20-18(15)19(25)14-6-3-4-7-17(14)26-20/h3-4,6-9,22-23H,5,10-13,21H2,1-2H3