1-(5-bromanyl-3-pyrrolidin-1-ylsulfonyl-1H-indol-2-yl)-3-(2-pyridin-2-ylethyl)urea

Systemtic Name: 1-(5-bromanyl-3-pyrrolidin-1-ylsulfonyl-1H-indol-2-yl)-3-(2-pyridin-2-ylethyl)urea Openeye Name: 1-(5-bromo-3-pyrrolidin-1-ylsulfonyl-1H-indol-2-yl)-3-[2-(2-pyridyl)ethyl]urea CAS Name: 1-[5-bromo-3-(1-pyrrolidinylsulfonyl)-1H-indol-2-yl]-3-[2-(2-pyridinyl)ethyl]urea IUPAC Name: 1-(5-bromo-3-pyrrolidin-1-ylsulfonyl-1H-indol-2-yl)-3-(2-pyridin-2-ylethyl)urea Traditional Name: 1-(5-bromo-3-pyrrolidinosulfonyl-1H-indol-2-yl)-3-[2-(2-pyridyl)ethyl]urea Formula: C20H22BrN5O3S MolecularWeight: 492.38938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Br)NC(=O)NCCC4=CC=CC=N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Br)NC(=O)NCCC4=CC=CC=N4

InChI

InChI=1S/C20H22BrN5O3S/c21-14-6-7-17-16(13-14)18(30(28,29)26-11-3-4-12-26)19(24-17)25-20(27)23-10-8-15-5-1-2-9-22-15/h1-2,5-7,9,13,24H,3-4,8,10-12H2,(H2,23,25,27)