N-[5-iodanyl-2-[(3S)-3-methylmorpholin-4-yl]carbonyl-phenyl]quinoxaline-5-sulfonamide

Systemtic Name: N-[5-iodanyl-2-[(3S)-3-methylmorpholin-4-yl]carbonyl-phenyl]quinoxaline-5-sulfonamide Openeye Name: N-[5-iodo-2-[(3S)-3-methylmorpholine-4-carbonyl]phenyl]quinoxaline-5-sulfonamide CAS Name: N-[5-iodo-2-[[(3S)-3-methyl-4-morpholinyl]-oxomethyl]phenyl]-5-quinoxalinesulfonamide IUPAC Name: N-[5-iodo-2-[(3S)-3-methylmorpholine-4-carbonyl]phenyl]quinoxaline-5-sulfonamide Traditional Name: N-[5-iodo-2-[(3S)-3-methylmorpholine-4-carbonyl]phenyl]quinoxaline-5-sulfonamide Formula: C20H19IN4O4S MolecularWeight: 538.35873

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1COCCN1C(=O)C2=C(C=C(C=C2)I)NS(=O)(=O)C3=CC=CC4=NC=CN=C43

Isomeric SMILES

C[C@H]1COCCN1C(=O)C2=C(C=C(C=C2)I)NS(=O)(=O)C3=CC=CC4=NC=CN=C43

InChI

InChI=1S/C20H19IN4O4S/c1-13-12-29-10-9-25(13)20(26)15-6-5-14(21)11-17(15)24-30(27,28)18-4-2-3-16-19(18)23-8-7-22-16/h2-8,11,13,24H,9-10,12H2,1H3/t13-/m0/s1