N-[(5-bromanyl-2-methoxy-phenyl)methyl]-2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1H-quinoline-4-carboxamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1H-quinoline-4-carboxamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-2-oxo-6-pyrrolidin-1-ylsulfonyl-1H-quinoline-4-carboxamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-2-oxo-6-(1-pyrrolidinylsulfonyl)-1H-quinoline-4-carboxamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-2-oxo-6-pyrrolidin-1-ylsulfonyl-1H-quinoline-4-carboxamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-2-keto-6-pyrrolidinosulfonyl-1H-quinoline-4-carboxamide Formula: C22H22BrN3O5S MolecularWeight: 520.39618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CNC(=O)C2=CC(=O)NC3=C2C=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CNC(=O)C2=CC(=O)NC3=C2C=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H22BrN3O5S/c1-31-20-7-4-15(23)10-14(20)13-24-22(28)18-12-21(27)25-19-6-5-16(11-17(18)19)32(29,30)26-8-2-3-9-26/h4-7,10-12H,2-3,8-9,13H2,1H3,(H,24,28)(H,25,27)