3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfanylmethyl]-1H-indole-5-carboxamide

Systemtic Name: 3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfanylmethyl]-1H-indole-5-carboxamide Openeye Name: 3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfanylmethyl]-1H-indole-5-carboxamide CAS Name: 3-[[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylthio]methyl]-1H-indole-5-carboxamide IUPAC Name: 3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfanylmethyl]-1H-indole-5-carboxamide Traditional Name: 3-[[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylthio]methyl]-1H-indole-5-carboxamide Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(CC(N1)CCSCC2=CNC3=C2C=C(C=C3)C(=O)N)C4=CC=CC=C4

Isomeric SMILES

C1C=C(CC(N1)CCSCC2=CNC3=C2C=C(C=C3)C(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3OS/c24-23(27)18-6-7-22-21(13-18)19(14-26-22)15-28-11-9-20-12-17(8-10-25-20)16-4-2-1-3-5-16/h1-8,13-14,20,25-26H,9-12,15H2,(H2,24,27)