N-propyl-3-[9-[3-(propylamino)propyl]thioxanthen-9-yl]propan-1-amine dihydrochloride

Systemtic Name: N-propyl-3-[9-[3-(propylamino)propyl]thioxanthen-9-yl]propan-1-amine dihydrochloride Openeye Name: N-propyl-3-[9-[3-(propylamino)propyl]thioxanthen-9-yl]propan-1-amine dihydrochloride CAS Name: N-propyl-3-[9-[3-(propylamino)propyl]-9-thioxanthenyl]-1-propanamine dihydrochloride IUPAC Name: N-propyl-3-[9-[3-(propylamino)propyl]thioxanthen-9-yl]propan-1-amine dihydrochloride Traditional Name: propyl-[3-[9-[3-(propylamino)propyl]thioxanthen-9-yl]propyl]amine dihydrochloride Formula: C25H38Cl2N2S MolecularWeight: 469.55362

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCCCC1(C2=CC=CC=C2SC3=CC=CC=C31)CCCNCCC.Cl.Cl

Isomeric SMILES

CCCNCCCC1(C2=CC=CC=C2SC3=CC=CC=C31)CCCNCCC.Cl.Cl

InChI

InChI=1S/C25H36N2S.2ClH/c1-3-17-26-19-9-15-25(16-10-20-27-18-4-2)21-11-5-7-13-23(21)28-24-14-8-6-12-22(24)25;;/h5-8,11-14,26-27H,3-4,9-10,15-20H2,1-2H3;2*1H