4-[4-(butylamino)butoxy]thioxanthen-9-one

Systemtic Name: 4-[4-(butylamino)butoxy]thioxanthen-9-one Openeye Name: 4-[4-(butylamino)butoxy]thioxanthen-9-one CAS Name: 4-[4-(butylamino)butoxy]-9-thioxanthenone IUPAC Name: 4-[4-(butylamino)butoxy]thioxanthen-9-one Traditional Name: 4-[4-(butylamino)butoxy]thioxanthen-9-one Formula: C21H25NO2S MolecularWeight: 355.4937

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCCCOC1=CC=CC2=C1SC3=CC=CC=C3C2=O

Isomeric SMILES

CCCCNCCCCOC1=CC=CC2=C1SC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H25NO2S/c1-2-3-13-22-14-6-7-15-24-18-11-8-10-17-20(23)16-9-4-5-12-19(16)25-21(17)18/h4-5,8-12,22H,2-3,6-7,13-15H2,1H3