4-(dimethylamino)-1-[5-[4-(dimethylamino)butanoyl]-9H-thioxanthen-3-yl]butan-1-one

Systemtic Name: 4-(dimethylamino)-1-[5-[4-(dimethylamino)butanoyl]-9H-thioxanthen-3-yl]butan-1-one Openeye Name: 4-(dimethylamino)-1-[5-[4-(dimethylamino)butanoyl]-9H-thioxanthen-3-yl]butan-1-one CAS Name: 4-(dimethylamino)-1-[5-[4-(dimethylamino)-1-oxobutyl]-9H-thioxanthen-3-yl]-1-butanone IUPAC Name: 4-(dimethylamino)-1-[5-[4-(dimethylamino)butanoyl]-9H-thioxanthen-3-yl]butan-1-one Traditional Name: 4-(dimethylamino)-1-[5-[4-(dimethylamino)butanoyl]-9H-thioxanthen-3-yl]butan-1-one Formula: C25H32N2O2S MolecularWeight: 424.59878

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCC(=O)C1=CC2=C(CC3=CC=CC(=C3S2)C(=O)CCCN(C)C)C=C1

Isomeric SMILES

CN(C)CCCC(=O)C1=CC2=C(CC3=CC=CC(=C3S2)C(=O)CCCN(C)C)C=C1

InChI

InChI=1S/C25H32N2O2S/c1-26(2)14-6-10-22(28)18-12-13-19-16-20-8-5-9-21(25(20)30-24(19)17-18)23(29)11-7-15-27(3)4/h5,8-9,12-13,17H,6-7,10-11,14-16H2,1-4H3