2-[(3-bromophenyl)methylsulfonylmethyl]-N-(2-diethylaminoethyl)-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxamide

Systemtic Name: 2-[(3-bromophenyl)methylsulfonylmethyl]-N-(2-diethylaminoethyl)-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: 2-[(3-bromophenyl)methylsulfonylmethyl]-N-(2-diethylaminoethyl)-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: 2-[(3-bromophenyl)methylsulfonylmethyl]-N-(2-diethylaminoethyl)-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: 2-[(3-bromophenyl)methylsulfonylmethyl]-N-(2-diethylaminoethyl)-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: 2-[(3-bromobenzyl)sulfonylmethyl]-N-(2-diethylaminoethyl)-3-keto-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C23H29BrN4O4S MolecularWeight: 537.46976

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC2=C(C=C1)NC(C(=O)N2)CS(=O)(=O)CC3=CC(=CC=C3)Br

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC2=C(C=C1)NC(C(=O)N2)CS(=O)(=O)CC3=CC(=CC=C3)Br

InChI

InChI=1S/C23H29BrN4O4S/c1-3-28(4-2)11-10-25-22(29)17-8-9-19-20(13-17)27-23(30)21(26-19)15-33(31,32)14-16-6-5-7-18(24)12-16/h5-9,12-13,21,26H,3-4,10-11,14-15H2,1-2H3,(H,25,29)(H,27,30)