3-[2-[4-(4-butylsulfanylphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole

Systemtic Name: 3-[2-[4-(4-butylsulfanylphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole Openeye Name: 3-[2-[4-(4-butylsulfanylphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole CAS Name: 3-[[2-[4-[4-(butylthio)phenyl]-1,2,3,6-tetrahydropyridin-2-yl]ethylthio]methyl]-1H-indole IUPAC Name: 3-[2-[4-(4-butylsulfanylphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole Traditional Name: 3-[[2-[4-[4-(butylthio)phenyl]-1,2,3,6-tetrahydropyridin-2-yl]ethylthio]methyl]-1H-indole Formula: C26H32N2S2 MolecularWeight: 436.67568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=C(C=C1)C2=CCNC(C2)CCSCC3=CNC4=CC=CC=C43

Isomeric SMILES

CCCCSC1=CC=C(C=C1)C2=CCNC(C2)CCSCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C26H32N2S2/c1-2-3-15-30-24-10-8-20(9-11-24)21-12-14-27-23(17-21)13-16-29-19-22-18-28-26-7-5-4-6-25(22)26/h4-12,18,23,27-28H,2-3,13-17,19H2,1H3