N-[5-[[3-(1-cyanocyclobutyl)phenyl]carbonylamino]-2-methyl-phenyl]quinoxaline-6-carboxamide

Systemtic Name: N-[5-[[3-(1-cyanocyclobutyl)phenyl]carbonylamino]-2-methyl-phenyl]quinoxaline-6-carboxamide Openeye Name: N-[5-[[3-(1-cyanocyclobutyl)benzoyl]amino]-2-methyl-phenyl]quinoxaline-6-carboxamide CAS Name: N-[5-[[[3-(1-cyanocyclobutyl)phenyl]-oxomethyl]amino]-2-methylphenyl]-6-quinoxalinecarboxamide IUPAC Name: N-[5-[[3-(1-cyanocyclobutyl)benzoyl]amino]-2-methylphenyl]quinoxaline-6-carboxamide Traditional Name: N-[5-[[3-(1-cyanocyclobutyl)benzoyl]amino]-2-methyl-phenyl]quinoxaline-6-carboxamide Formula: C28H23N5O2 MolecularWeight: 461.51452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C3(CCC3)C#N)NC(=O)C4=CC5=NC=CN=C5C=C4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C3(CCC3)C#N)NC(=O)C4=CC5=NC=CN=C5C=C4

InChI

InChI=1S/C28H23N5O2/c1-18-6-8-22(32-26(34)19-4-2-5-21(14-19)28(17-29)10-3-11-28)16-24(18)33-27(35)20-7-9-23-25(15-20)31-13-12-30-23/h2,4-9,12-16H,3,10-11H2,1H3,(H,32,34)(H,33,35)