6-butylsulfanyl-3-[4-(4-thiophen-2-yl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole

Systemtic Name: 6-butylsulfanyl-3-[4-(4-thiophen-2-yl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole Openeye Name: 6-butylsulfanyl-3-[4-[4-(2-thienyl)-1,2,3,6-tetrahydropyridin-2-yl]butyl]-1H-indole CAS Name: 6-(butylthio)-3-[4-(4-thiophen-2-yl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole IUPAC Name: 6-butylsulfanyl-3-[4-(4-thiophen-2-yl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole Traditional Name: 6-(butylthio)-3-[4-[4-(2-thienyl)-1,2,3,6-tetrahydropyridin-2-yl]butyl]-1H-indole Formula: C25H32N2S2 MolecularWeight: 424.66498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC2=C(C=C1)C(=CN2)CCCCC3CC(=CCN3)C4=CC=CS4

Isomeric SMILES

CCCCSC1=CC2=C(C=C1)C(=CN2)CCCCC3CC(=CCN3)C4=CC=CS4

InChI

InChI=1S/C25H32N2S2/c1-2-3-14-28-22-10-11-23-20(18-27-24(23)17-22)7-4-5-8-21-16-19(12-13-26-21)25-9-6-15-29-25/h6,9-12,15,17-18,21,26-27H,2-5,7-8,13-14,16H2,1H3