N-[2-[2-[(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)amino]ethyl-methyl-amino]ethyl]quinoxaline-2-carboxamide

Systemtic Name: N-[2-[2-[(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)amino]ethyl-methyl-amino]ethyl]quinoxaline-2-carboxamide Openeye Name: N-[2-[2-[(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)amino]ethyl-methyl-amino]ethyl]quinoxaline-2-carboxamide CAS Name: N-[2-[2-[[2,6-bis(1-pyrrolidinyl)-4-pyrimidinyl]amino]ethyl-methylamino]ethyl]-2-quinoxalinecarboxamide IUPAC Name: N-[2-[2-[(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)amino]ethyl-methylamino]ethyl]quinoxaline-2-carboxamide Traditional Name: N-[2-[2-[(2,6-dipyrrolidinopyrimidin-4-yl)amino]ethyl-methyl-amino]ethyl]quinoxaline-2-carboxamide Formula: C26H35N9O MolecularWeight: 489.6158

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCNC1=NC(=NC(=C1)N2CCCC2)N3CCCC3)CCNC(=O)C4=NC5=CC=CC=C5N=C4

Isomeric SMILES

CN(CCNC1=NC(=NC(=C1)N2CCCC2)N3CCCC3)CCNC(=O)C4=NC5=CC=CC=C5N=C4

InChI

InChI=1S/C26H35N9O/c1-33(17-11-28-25(36)22-19-29-20-8-2-3-9-21(20)30-22)16-10-27-23-18-24(34-12-4-5-13-34)32-26(31-23)35-14-6-7-15-35/h2-3,8-9,18-19H,4-7,10-17H2,1H3,(H,28,36)(H,27,31,32)