N-[3-[(3,5-dimethoxyphenyl)amino]quinoxalin-2-yl]-4-(morpholin-4-ylmethyl)benzenesulfonamide

Systemtic Name: N-[3-[(3,5-dimethoxyphenyl)amino]quinoxalin-2-yl]-4-(morpholin-4-ylmethyl)benzenesulfonamide Openeye Name: N-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]-4-(morpholinomethyl)benzenesulfonamide CAS Name: N-[3-(3,5-dimethoxyanilino)-2-quinoxalinyl]-4-(4-morpholinylmethyl)benzenesulfonamide IUPAC Name: N-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]-4-(morpholin-4-ylmethyl)benzenesulfonamide Traditional Name: N-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]-4-(morpholinomethyl)benzenesulfonamide Formula: C27H29N5O5S MolecularWeight: 535.61466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)CN5CCOCC5)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)CN5CCOCC5)OC

InChI

InChI=1S/C27H29N5O5S/c1-35-21-15-20(16-22(17-21)36-2)28-26-27(30-25-6-4-3-5-24(25)29-26)31-38(33,34)23-9-7-19(8-10-23)18-32-11-13-37-14-12-32/h3-10,15-17H,11-14,18H2,1-2H3,(H,28,29)(H,30,31)