2-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(6-pyrrolidin-1-ylpyridin-3-yl)ethanamide

Systemtic Name: 2-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(6-pyrrolidin-1-ylpyridin-3-yl)ethanamide Openeye Name: 2-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(6-pyrrolidin-1-yl-3-pyridyl)acetamide CAS Name: 2-[(4-bromophenyl)sulfonyl-methylamino]-N-[6-(1-pyrrolidinyl)-3-pyridinyl]acetamide IUPAC Name: 2-[(4-bromophenyl)sulfonyl-methylamino]-N-(6-pyrrolidin-1-ylpyridin-3-yl)acetamide Traditional Name: 2-[brosyl(methyl)amino]-N-(6-pyrrolidino-3-pyridyl)acetamide Formula: C18H21BrN4O3S MolecularWeight: 453.35334

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CN=C(C=C1)N2CCCC2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CN(CC(=O)NC1=CN=C(C=C1)N2CCCC2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H21BrN4O3S/c1-22(27(25,26)16-7-4-14(19)5-8-16)13-18(24)21-15-6-9-17(20-12-15)23-10-2-3-11-23/h4-9,12H,2-3,10-11,13H2,1H3,(H,21,24)