(2R)-2-[3-[butyl(pentyl)amino]quinoxalin-2-yl]-2-cyano-N-prop-2-enyl-ethanamide

Systemtic Name: (2R)-2-[3-[butyl(pentyl)amino]quinoxalin-2-yl]-2-cyano-N-prop-2-enyl-ethanamide Openeye Name: (2R)-N-allyl-2-[3-[butyl(pentyl)amino]quinoxalin-2-yl]-2-cyano-acetamide CAS Name: (2R)-2-[3-[butyl(pentyl)amino]-2-quinoxalinyl]-2-cyano-N-prop-2-enylacetamide IUPAC Name: (2R)-2-[3-[butyl(pentyl)amino]quinoxalin-2-yl]-2-cyano-N-prop-2-enylacetamide Traditional Name: (2R)-N-allyl-2-[3-[amyl(butyl)amino]quinoxalin-2-yl]-2-cyano-acetamide Formula: C23H31N5O MolecularWeight: 393.52514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCN(CCCC)C1=NC2=CC=CC=C2N=C1[C@H](C#N)C(=O)NCC=C

InChI

InChI=1S/C23H31N5O/c1-4-7-11-16-28(15-8-5-2)22-21(18(17-24)23(29)25-14-6-3)26-19-12-9-10-13-20(19)27-22/h6,9-10,12-13,18H,3-5,7-8,11,14-16H2,1-2H3,(H,25,29)/t18-/m0/s1