methyl 2-[4-[(7-methyl-2-methylsulfanyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]benzoate

Systemtic Name: methyl 2-[4-[(7-methyl-2-methylsulfanyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[(7-methyl-2-methylsulfanyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]benzoate CAS Name: 2-[4-[[7-methyl-2-(methylthio)-3-imidazo[4,5-b]pyridinyl]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[(7-methyl-2-methylsulfanylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]benzoate Traditional Name: 2-[4-[[7-methyl-2-(methylthio)imidazo[4,5-b]pyridin-3-yl]methyl]phenyl]benzoic acid methyl ester Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC=C1)N(C(=N2)SC)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC

Isomeric SMILES

CC1=C2C(=NC=C1)N(C(=N2)SC)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C23H21N3O2S/c1-15-12-13-24-21-20(15)25-23(29-3)26(21)14-16-8-10-17(11-9-16)18-6-4-5-7-19(18)22(27)28-2/h4-13H,14H2,1-3H3