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

Systemtic Name: 2-[(3-bromophenyl)methylsulfonylmethyl]-N-[2-(dipropylamino)ethyl]-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: 2-[(3-bromophenyl)methylsulfonylmethyl]-N-[2-(dipropylamino)ethyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: 2-[(3-bromophenyl)methylsulfonylmethyl]-N-[2-(dipropylamino)ethyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: 2-[(3-bromophenyl)methylsulfonylmethyl]-N-[2-(dipropylamino)ethyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: 2-[(3-bromobenzyl)sulfonylmethyl]-N-[2-(dipropylamino)ethyl]-3-keto-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C25H33BrN4O4S MolecularWeight: 565.52292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33BrN4O4S/c1-3-11-30(12-4-2)13-10-27-24(31)19-8-9-21-22(15-19)29-25(32)23(28-21)17-35(33,34)16-18-6-5-7-20(26)14-18/h5-9,14-15,23,28H,3-4,10-13,16-17H2,1-2H3,(H,27,31)(H,29,32)