5-[(4-tert-butylphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)-3-thiophen-2-yl-1H-pyrrolo[2,3-b]pyridine-2-carboxamide

Systemtic Name: 5-[(4-tert-butylphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)-3-thiophen-2-yl-1H-pyrrolo[2,3-b]pyridine-2-carboxamide Openeye Name: 5-[(4-tert-butylphenyl)sulfonylamino]-N-(tetrahydrofuran-2-ylmethyl)-3-(2-thienyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide CAS Name: 5-[(4-tert-butylphenyl)sulfonylamino]-N-(2-oxolanylmethyl)-3-thiophen-2-yl-1H-pyrrolo[2,3-b]pyridine-2-carboxamide IUPAC Name: 5-[(4-tert-butylphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)-3-thiophen-2-yl-1H-pyrrolo[2,3-b]pyridine-2-carboxamide Traditional Name: 5-[(4-tert-butylphenyl)sulfonylamino]-N-(tetrahydrofurfuryl)-3-(2-thienyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide Formula: C27H30N4O4S2 MolecularWeight: 538.6815

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CN=C3C(=C2)C(=C(N3)C(=O)NCC4CCCO4)C5=CC=CS5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CN=C3C(=C2)C(=C(N3)C(=O)NCC4CCCO4)C5=CC=CS5

InChI

InChI=1S/C27H30N4O4S2/c1-27(2,3)17-8-10-20(11-9-17)37(33,34)31-18-14-21-23(22-7-5-13-36-22)24(30-25(21)28-15-18)26(32)29-16-19-6-4-12-35-19/h5,7-11,13-15,19,31H,4,6,12,16H2,1-3H3,(H,28,30)(H,29,32)