N-(3-methylsulfanylphenyl)-3-[3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-2-yl]propanamide

Systemtic Name: N-(3-methylsulfanylphenyl)-3-[3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-2-yl]propanamide Openeye Name: N-(3-methylsulfanylphenyl)-3-[3-(2-thienylmethyl)imidazo[4,5-b]pyridin-2-yl]propanamide CAS Name: N-[3-(methylthio)phenyl]-3-[3-(thiophen-2-ylmethyl)-2-imidazo[4,5-b]pyridinyl]propanamide IUPAC Name: N-(3-methylsulfanylphenyl)-3-[3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-2-yl]propanamide Traditional Name: N-[3-(methylthio)phenyl]-3-[3-(2-thenyl)imidazo[4,5-b]pyridin-2-yl]propionamide Formula: C21H20N4OS2 MolecularWeight: 408.5397

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)CCC2=NC3=C(N2CC4=CC=CS4)N=CC=C3

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)CCC2=NC3=C(N2CC4=CC=CS4)N=CC=C3

InChI

InChI=1S/C21H20N4OS2/c1-27-16-6-2-5-15(13-16)23-20(26)10-9-19-24-18-8-3-11-22-21(18)25(19)14-17-7-4-12-28-17/h2-8,11-13H,9-10,14H2,1H3,(H,23,26)