2-[3-[bis(2-methylpropyl)amino]quinoxalin-2-yl]-2-cyano-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[3-[bis(2-methylpropyl)amino]quinoxalin-2-yl]-2-cyano-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-cyano-2-[3-(diisobutylamino)quinoxalin-2-yl]acetamide CAS Name: 2-[3-[bis(2-methylpropyl)amino]-2-quinoxalinyl]-2-cyano-N-prop-2-enylacetamide IUPAC Name: 2-[3-[bis(2-methylpropyl)amino]quinoxalin-2-yl]-2-cyano-N-prop-2-enylacetamide Traditional Name: N-allyl-2-cyano-2-[3-(diisobutylamino)quinoxalin-2-yl]acetamide Formula: C22H29N5O MolecularWeight: 379.49856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C1=NC2=CC=CC=C2N=C1C(C#N)C(=O)NCC=C

Isomeric SMILES

CC(C)CN(CC(C)C)C1=NC2=CC=CC=C2N=C1C(C#N)C(=O)NCC=C

InChI

InChI=1S/C22H29N5O/c1-6-11-24-22(28)17(12-23)20-21(27(13-15(2)3)14-16(4)5)26-19-10-8-7-9-18(19)25-20/h6-10,15-17H,1,11,13-14H2,2-5H3,(H,24,28)