5-bromanyl-2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)benzenesulfonamide

Systemtic Name: 5-bromanyl-2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)benzenesulfonamide Openeye Name: 5-bromo-2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)benzenesulfonamide CAS Name: 5-bromo-2-methoxy-N-[3-(1-pyrrolidinyl)-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 5-bromo-2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)benzenesulfonamide Traditional Name: 5-bromo-2-methoxy-N-(3-pyrrolidinoquinoxalin-2-yl)benzenesulfonamide Formula: C19H19BrN4O3S MolecularWeight: 463.34816

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2N4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2N4CCCC4

InChI

InChI=1S/C19H19BrN4O3S/c1-27-16-9-8-13(20)12-17(16)28(25,26)23-18-19(24-10-4-5-11-24)22-15-7-3-2-6-14(15)21-18/h2-3,6-9,12H,4-5,10-11H2,1H3,(H,21,23)