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

Systemtic Name: 3-[2-[4-(4-hydroxyphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole-5-carboxamide Openeye Name: 3-[2-[4-(4-hydroxyphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole-5-carboxamide CAS Name: 3-[[2-[4-(4-hydroxyphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylthio]methyl]-1H-indole-5-carboxamide IUPAC Name: 3-[2-[4-(4-hydroxyphenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole-5-carboxamide Traditional Name: 3-[[2-[4-(4-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=C(CC(N1)CCSCC2=CNC3=C2C=C(C=C3)C(=O)N)C4=CC=C(C=C4)O

Isomeric SMILES

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

InChI

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