(2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-2-[3-(4-methylpiperazin-1-yl)quinoxalin-2-yl]ethanamide

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-2-[3-(4-methylpiperazin-1-yl)quinoxalin-2-yl]ethanamide Openeye Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-2-[3-(4-methylpiperazin-1-yl)quinoxalin-2-yl]acetamide CAS Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-2-[3-(4-methyl-1-piperazinyl)-2-quinoxalinyl]acetamide IUPAC Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-2-[3-(4-methylpiperazin-1-yl)quinoxalin-2-yl]acetamide Traditional Name: (2R)-2-cyano-2-[3-(4-methylpiperazino)quinoxalin-2-yl]-N-piperonyl-acetamide Formula: C24H24N6O3 MolecularWeight: 444.48576

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1CCN(CC1)C2=NC3=CC=CC=C3N=C2[C@H](C#N)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H24N6O3/c1-29-8-10-30(11-9-29)23-22(27-18-4-2-3-5-19(18)28-23)17(13-25)24(31)26-14-16-6-7-20-21(12-16)33-15-32-20/h2-7,12,17H,8-11,14-15H2,1H3,(H,26,31)/t17-/m0/s1