2-bromanyl-5-piperidin-1-ylsulfonyl-N-(3-pyrazol-1-ylpropyl)benzamide

Systemtic Name: 2-bromanyl-5-piperidin-1-ylsulfonyl-N-(3-pyrazol-1-ylpropyl)benzamide Openeye Name: 2-bromo-5-(1-piperidylsulfonyl)-N-(3-pyrazol-1-ylpropyl)benzamide CAS Name: 2-bromo-5-(1-piperidinylsulfonyl)-N-[3-(1-pyrazolyl)propyl]benzamide IUPAC Name: 2-bromo-5-piperidin-1-ylsulfonyl-N-(3-pyrazol-1-ylpropyl)benzamide Traditional Name: 2-bromo-5-piperidinosulfonyl-N-(3-pyrazol-1-ylpropyl)benzamide Formula: C18H23BrN4O3S MolecularWeight: 455.36922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NCCCN3C=CC=N3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NCCCN3C=CC=N3

InChI

InChI=1S/C18H23BrN4O3S/c19-17-7-6-15(27(25,26)23-12-2-1-3-13-23)14-16(17)18(24)20-8-4-10-22-11-5-9-21-22/h5-7,9,11,14H,1-4,8,10,12-13H2,(H,20,24)