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

Systemtic Name: 3-methylbutyl N-[2-[4-[(6-benzamido-7-methyl-2-propyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]phenyl]sulfonylcarbamate Openeye Name: isopentyl N-[2-[4-[(6-benzamido-7-methyl-2-propyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]phenyl]sulfonylcarbamate CAS Name: N-[2-[4-[(6-benzamido-7-methyl-2-propyl-3-imidazo[4,5-b]pyridinyl)methyl]phenyl]phenyl]sulfonylcarbamic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl N-[2-[4-[(6-benzamido-7-methyl-2-propylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]phenyl]sulfonylcarbamate Traditional Name: N-[2-[4-[(6-benzamido-7-methyl-2-propyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]phenyl]sulfonylcarbamic acid isoamyl ester Formula: C36H39N5O5S MolecularWeight: 653.79036

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C(=CN=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)NC(=O)OCCC(C)C)NC(=O)C5=CC=CC=C5)C

Isomeric SMILES

CCCC1=NC2=C(C(=CN=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)NC(=O)OCCC(C)C)NC(=O)C5=CC=CC=C5)C

InChI

InChI=1S/C36H39N5O5S/c1-5-11-32-39-33-25(4)30(38-35(42)28-12-7-6-8-13-28)22-37-34(33)41(32)23-26-16-18-27(19-17-26)29-14-9-10-15-31(29)47(44,45)40-36(43)46-21-20-24(2)3/h6-10,12-19,22,24H,5,11,20-21,23H2,1-4H3,(H,38,42)(H,40,43)