4-azanyl-1-(2-dimethylaminoethylamino)thioxanthen-9-one

Systemtic Name: 4-azanyl-1-(2-dimethylaminoethylamino)thioxanthen-9-one Openeye Name: 4-amino-1-(2-dimethylaminoethylamino)thioxanthen-9-one CAS Name: 4-amino-1-(2-dimethylaminoethylamino)-9-thioxanthenone IUPAC Name: 4-amino-1-(2-dimethylaminoethylamino)thioxanthen-9-one Traditional Name: 4-amino-1-(2-dimethylaminoethylamino)thioxanthen-9-one Formula: C17H19N3OS MolecularWeight: 313.41726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3OS/c1-20(2)10-9-19-13-8-7-12(18)17-15(13)16(21)11-5-3-4-6-14(11)22-17/h3-8,19H,9-10,18H2,1-2H3