3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfanylmethyl]-1H-indole-7-carboxamide

Systemtic Name: 3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfanylmethyl]-1H-indole-7-carboxamide Openeye Name: 3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfanylmethyl]-1H-indole-7-carboxamide CAS Name: 3-[[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylthio]methyl]-1H-indole-7-carboxamide IUPAC Name: 3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfanylmethyl]-1H-indole-7-carboxamide Traditional Name: 3-[[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylthio]methyl]-1H-indole-7-carboxamide Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(CC(N1)CCSCC2=CNC3=C2C=CC=C3C(=O)N)C4=CC=CC=C4

Isomeric SMILES

C1C=C(CC(N1)CCSCC2=CNC3=C2C=CC=C3C(=O)N)C4=CC=CC=C4

InChI

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