N-(pyridin-2-ylmethyl)-3-pyrrolidin-1-ylsulfonyl-5-(thiophen-2-ylmethylamino)benzamide

Systemtic Name: N-(pyridin-2-ylmethyl)-3-pyrrolidin-1-ylsulfonyl-5-(thiophen-2-ylmethylamino)benzamide Openeye Name: N-(2-pyridylmethyl)-3-pyrrolidin-1-ylsulfonyl-5-(2-thienylmethylamino)benzamide CAS Name: N-(2-pyridinylmethyl)-3-(1-pyrrolidinylsulfonyl)-5-(thiophen-2-ylmethylamino)benzamide IUPAC Name: N-(pyridin-2-ylmethyl)-3-pyrrolidin-1-ylsulfonyl-5-(thiophen-2-ylmethylamino)benzamide Traditional Name: N-(2-pyridylmethyl)-3-pyrrolidinosulfonyl-5-(2-thenylamino)benzamide Formula: C22H24N4O3S2 MolecularWeight: 456.58096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=CC(=C2)NCC3=CC=CS3)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=CC(=C2)NCC3=CC=CS3)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C22H24N4O3S2/c27-22(25-15-18-6-1-2-8-23-18)17-12-19(24-16-20-7-5-11-30-20)14-21(13-17)31(28,29)26-9-3-4-10-26/h1-2,5-8,11-14,24H,3-4,9-10,15-16H2,(H,25,27)