2-[(4-tert-butylphenyl)methylsulfanyl]-6-chloranyl-1H-imidazo[4,5-b]pyridine

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-6-chloranyl-1H-imidazo[4,5-b]pyridine Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-6-chloro-1H-imidazo[4,5-b]pyridine CAS Name: 2-[(4-tert-butylphenyl)methylthio]-6-chloro-1H-imidazo[4,5-b]pyridine IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-6-chloro-1H-imidazo[4,5-b]pyridine Traditional Name: 2-[(4-tert-butylbenzyl)thio]-6-chloro-1H-imidazo[4,5-b]pyridine Formula: C17H18ClN3S MolecularWeight: 331.86292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=NC=C(C=C3N2)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=NC=C(C=C3N2)Cl

InChI

InChI=1S/C17H18ClN3S/c1-17(2,3)12-6-4-11(5-7-12)10-22-16-20-14-8-13(18)9-19-15(14)21-16/h4-9H,10H2,1-3H3,(H,19,20,21)