N-[3-cyano-4-[4-(oxan-4-yl)piperazin-1-yl]phenyl]quinoxaline-2-carboxamide

Systemtic Name: N-[3-cyano-4-[4-(oxan-4-yl)piperazin-1-yl]phenyl]quinoxaline-2-carboxamide Openeye Name: N-[3-cyano-4-(4-tetrahydropyran-4-ylpiperazin-1-yl)phenyl]quinoxaline-2-carboxamide CAS Name: N-[3-cyano-4-[4-(4-oxanyl)-1-piperazinyl]phenyl]-2-quinoxalinecarboxamide IUPAC Name: N-[3-cyano-4-[4-(oxan-4-yl)piperazin-1-yl]phenyl]quinoxaline-2-carboxamide Traditional Name: N-[3-cyano-4-(4-tetrahydropyran-4-ylpiperazino)phenyl]quinoxaline-2-carboxamide Formula: C25H26N6O2 MolecularWeight: 442.51294

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=NC5=CC=CC=C5N=C4)C#N

Isomeric SMILES

C1COCCC1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=NC5=CC=CC=C5N=C4)C#N

InChI

InChI=1S/C25H26N6O2/c26-16-18-15-19(28-25(32)23-17-27-21-3-1-2-4-22(21)29-23)5-6-24(18)31-11-9-30(10-12-31)20-7-13-33-14-8-20/h1-6,15,17,20H,7-14H2,(H,28,32)