2-cycloheptyl-N-[(4-methylsulfonylphenyl)methyl]-6-(3-phenylpyrrolo[2,3-b]pyridin-1-yl)heptanamide

Systemtic Name: 2-cycloheptyl-N-[(4-methylsulfonylphenyl)methyl]-6-(3-phenylpyrrolo[2,3-b]pyridin-1-yl)heptanamide Openeye Name: 2-cycloheptyl-N-[(4-methylsulfonylphenyl)methyl]-6-(3-phenylpyrrolo[2,3-b]pyridin-1-yl)heptanamide CAS Name: 2-cycloheptyl-N-[(4-methylsulfonylphenyl)methyl]-6-(3-phenyl-1-pyrrolo[2,3-b]pyridinyl)heptanamide IUPAC Name: 2-cycloheptyl-N-[(4-methylsulfonylphenyl)methyl]-6-(3-phenylpyrrolo[2,3-b]pyridin-1-yl)heptanamide Traditional Name: 2-cycloheptyl-N-(4-mesylbenzyl)-6-(3-phenylpyrrolo[2,3-b]pyridin-1-yl)enanthamide Formula: C35H43N3O3S MolecularWeight: 585.79922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C1CCCCCC1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)C)N3C=C(C4=C3N=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(CCCC(C1CCCCCC1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)C)N3C=C(C4=C3N=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C35H43N3O3S/c1-26(38-25-33(29-15-8-5-9-16-29)32-18-11-23-36-34(32)38)12-10-17-31(28-13-6-3-4-7-14-28)35(39)37-24-27-19-21-30(22-20-27)42(2,40)41/h5,8-9,11,15-16,18-23,25-26,28,31H,3-4,6-7,10,12-14,17,24H2,1-2H3,(H,37,39)