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

Systemtic Name: 3-[2-[3-(4-hydroxyphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole-6-carboxamide Openeye Name: 3-[2-[3-(4-hydroxyphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole-6-carboxamide CAS Name: 3-[[2-[3-(4-hydroxyphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylthio]methyl]-1H-indole-6-carboxamide IUPAC Name: 3-[2-[3-(4-hydroxyphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole-6-carboxamide Traditional Name: 3-[[2-[3-(4-hydroxyphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylthio]methyl]-1H-indole-6-carboxamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O2S/c24-23(28)16-5-8-20-17(13-26-22(20)12-16)14-29-11-9-21-19(2-1-10-25-21)15-3-6-18(27)7-4-15/h1-8,12-13,19,21,25-27H,9-11,14H2,(H2,24,28)