butyl N-[2-[4-[(6-benzamido-7-methyl-2-propyl-imidazo[4,5-b]pyridin-3-yl)methyl]-3-fluoranyl-phenyl]phenyl]sulfonylcarbamate

Systemtic Name: butyl N-[2-[4-[(6-benzamido-7-methyl-2-propyl-imidazo[4,5-b]pyridin-3-yl)methyl]-3-fluoranyl-phenyl]phenyl]sulfonylcarbamate Openeye Name: butyl N-[2-[4-[(6-benzamido-7-methyl-2-propyl-imidazo[4,5-b]pyridin-3-yl)methyl]-3-fluoro-phenyl]phenyl]sulfonylcarbamate CAS Name: N-[2-[4-[(6-benzamido-7-methyl-2-propyl-3-imidazo[4,5-b]pyridinyl)methyl]-3-fluorophenyl]phenyl]sulfonylcarbamic acid butyl ester IUPAC Name: butyl N-[2-[4-[(6-benzamido-7-methyl-2-propylimidazo[4,5-b]pyridin-3-yl)methyl]-3-fluorophenyl]phenyl]sulfonylcarbamate Traditional Name: N-[2-[4-[(6-benzamido-7-methyl-2-propyl-imidazo[4,5-b]pyridin-3-yl)methyl]-3-fluoro-phenyl]phenyl]sulfonylcarbamic acid butyl ester Formula: C35H36FN5O5S MolecularWeight: 657.754243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NS(=O)(=O)C1=CC=CC=C1C2=CC(=C(C=C2)CN3C(=NC4=C(C(=CN=C43)NC(=O)C5=CC=CC=C5)C)CCC)F

Isomeric SMILES

CCCCOC(=O)NS(=O)(=O)C1=CC=CC=C1C2=CC(=C(C=C2)CN3C(=NC4=C(C(=CN=C43)NC(=O)C5=CC=CC=C5)C)CCC)F

InChI

InChI=1S/C35H36FN5O5S/c1-4-6-19-46-35(43)40-47(44,45)30-16-11-10-15-27(30)25-17-18-26(28(36)20-25)22-41-31(12-5-2)39-32-23(3)29(21-37-33(32)41)38-34(42)24-13-8-7-9-14-24/h7-11,13-18,20-21H,4-6,12,19,22H2,1-3H3,(H,38,42)(H,40,43)