N-butyl-4-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]sulfanylmethyl]benzamide

Systemtic Name: N-butyl-4-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]sulfanylmethyl]benzamide Openeye Name: N-butyl-4-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]sulfanylmethyl]benzamide CAS Name: N-butyl-4-[[[3-[(4-methoxyphenyl)methyl]-2-imidazo[4,5-b]pyridinyl]thio]methyl]benzamide IUPAC Name: N-butyl-4-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]sulfanylmethyl]benzamide Traditional Name: N-butyl-4-[[(3-p-anisylimidazo[4,5-b]pyridin-2-yl)thio]methyl]benzamide Formula: C26H28N4O2S MolecularWeight: 460.59112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=C(C=C1)CSC2=NC3=C(N2CC4=CC=C(C=C4)OC)N=CC=C3

Isomeric SMILES

CCCCNC(=O)C1=CC=C(C=C1)CSC2=NC3=C(N2CC4=CC=C(C=C4)OC)N=CC=C3

InChI

InChI=1S/C26H28N4O2S/c1-3-4-15-28-25(31)21-11-7-20(8-12-21)18-33-26-29-23-6-5-16-27-24(23)30(26)17-19-9-13-22(32-2)14-10-19/h5-14,16H,3-4,15,17-18H2,1-2H3,(H,28,31)