N-[2-oxidanylidene-2-[4-(2-oxidanylidene-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidin-1-yl]ethyl]quinoxaline-6-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-[4-(2-oxidanylidene-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidin-1-yl]ethyl]quinoxaline-6-carboxamide Openeye Name: N-[2-oxo-2-[4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)-1-piperidyl]ethyl]quinoxaline-6-carboxamide CAS Name: N-[2-oxo-2-[4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)-1-piperidinyl]ethyl]-6-quinoxalinecarboxamide IUPAC Name: N-[2-oxo-2-[4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidin-1-yl]ethyl]quinoxaline-6-carboxamide Traditional Name: N-[2-keto-2-[4-(2-keto-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidino]ethyl]quinoxaline-6-carboxamide Formula: C25H26N6O3 MolecularWeight: 458.51234

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCC3=CC=CC=C3NC2=O)C(=O)CNC(=O)C4=CC5=NC=CN=C5C=C4

Isomeric SMILES

C1CN(CCC1N2CCC3=CC=CC=C3NC2=O)C(=O)CNC(=O)C4=CC5=NC=CN=C5C=C4

InChI

InChI=1S/C25H26N6O3/c32-23(16-28-24(33)18-5-6-21-22(15-18)27-11-10-26-21)30-12-8-19(9-13-30)31-14-7-17-3-1-2-4-20(17)29-25(31)34/h1-6,10-11,15,19H,7-9,12-14,16H2,(H,28,33)(H,29,34)