N-phenethyl-2-[3-(phenylmethyl)imidazo[4,5-b]pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-phenethyl-2-[3-(phenylmethyl)imidazo[4,5-b]pyridin-2-yl]sulfanyl-ethanamide Openeye Name: 2-(3-benzylimidazo[4,5-b]pyridin-2-yl)sulfanyl-N-phenethyl-acetamide CAS Name: N-phenethyl-2-[[3-(phenylmethyl)-2-imidazo[4,5-b]pyridinyl]thio]acetamide IUPAC Name: 2-(3-benzylimidazo[4,5-b]pyridin-2-yl)sulfanyl-N-phenethylacetamide Traditional Name: 2-[(3-benzylimidazo[4,5-b]pyridin-2-yl)thio]-N-phenethyl-acetamide Formula: C23H22N4OS MolecularWeight: 402.51198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22N4OS/c28-21(24-15-13-18-8-3-1-4-9-18)17-29-23-26-20-12-7-14-25-22(20)27(23)16-19-10-5-2-6-11-19/h1-12,14H,13,15-17H2,(H,24,28)