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

Systemtic Name: 3-[2-[3-(3-hydroxyphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole-5-carboxamide Openeye Name: 3-[2-[3-(3-hydroxyphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole-5-carboxamide CAS Name: 3-[[2-[3-(3-hydroxyphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylthio]methyl]-1H-indole-5-carboxamide IUPAC Name: 3-[2-[3-(3-hydroxyphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole-5-carboxamide Traditional Name: 3-[[2-[3-(3-hydroxyphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylthio]methyl]-1H-indole-5-carboxamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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