2,3-dimethyl-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]quinoxaline-6-carboxamide

Systemtic Name: 2,3-dimethyl-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]quinoxaline-6-carboxamide Openeye Name: 2,3-dimethyl-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]quinoxaline-6-carboxamide CAS Name: 2,3-dimethyl-N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]-6-quinoxalinecarboxamide IUPAC Name: 2,3-dimethyl-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]quinoxaline-6-carboxamide Traditional Name: N-[4-(3-ketopiperazino)benzyl]-2,3-dimethyl-quinoxaline-6-carboxamide Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)N4CCNC(=O)C4)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)N4CCNC(=O)C4)N=C1C

InChI

InChI=1S/C22H23N5O2/c1-14-15(2)26-20-11-17(5-8-19(20)25-14)22(29)24-12-16-3-6-18(7-4-16)27-10-9-23-21(28)13-27/h3-8,11H,9-10,12-13H2,1-2H3,(H,23,28)(H,24,29)