3-[2-[3-(3-hydroxyphenyl)piperidin-1-yl]ethylsulfanylmethyl]-1H-indole-6-carboxamide

Systemtic Name: 3-[2-[3-(3-hydroxyphenyl)piperidin-1-yl]ethylsulfanylmethyl]-1H-indole-6-carboxamide Openeye Name: 3-[2-[3-(3-hydroxyphenyl)-1-piperidyl]ethylsulfanylmethyl]-1H-indole-6-carboxamide CAS Name: 3-[[2-[3-(3-hydroxyphenyl)-1-piperidinyl]ethylthio]methyl]-1H-indole-6-carboxamide IUPAC Name: 3-[2-[3-(3-hydroxyphenyl)piperidin-1-yl]ethylsulfanylmethyl]-1H-indole-6-carboxamide Traditional Name: 3-[[2-[3-(3-hydroxyphenyl)piperidino]ethylthio]methyl]-1H-indole-6-carboxamide Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCSCC2=CNC3=C2C=CC(=C3)C(=O)N)C4=CC(=CC=C4)O

Isomeric SMILES

C1CC(CN(C1)CCSCC2=CNC3=C2C=CC(=C3)C(=O)N)C4=CC(=CC=C4)O

InChI

InChI=1S/C23H27N3O2S/c24-23(28)17-6-7-21-19(13-25-22(21)12-17)15-29-10-9-26-8-2-4-18(14-26)16-3-1-5-20(27)11-16/h1,3,5-7,11-13,18,25,27H,2,4,8-10,14-15H2,(H2,24,28)