[6-(2-methylpropoxy)-5,7-bis(oxidanylidene)-2,3-dihydro-1H-pyrrolizin-8-yl]methyl 4-[4,6-bis(diethylamino)-1,3,5-triazin-2-yl]piperazine-1-carboxylate

Systemtic Name: [6-(2-methylpropoxy)-5,7-bis(oxidanylidene)-2,3-dihydro-1H-pyrrolizin-8-yl]methyl 4-[4,6-bis(diethylamino)-1,3,5-triazin-2-yl]piperazine-1-carboxylate Openeye Name: (6-isobutoxy-5,7-dioxo-2,3-dihydro-1H-pyrrolizin-8-yl)methyl 4-[4,6-bis(diethylamino)-1,3,5-triazin-2-yl]piperazine-1-carboxylate CAS Name: 4-[4,6-bis(diethylamino)-1,3,5-triazin-2-yl]-1-piperazinecarboxylic acid [6-(2-methylpropoxy)-5,7-dioxo-2,3-dihydro-1H-pyrrolizin-8-yl]methyl ester IUPAC Name: [6-(2-methylpropoxy)-5,7-dioxo-2,3-dihydro-1H-pyrrolizin-8-yl]methyl 4-[4,6-bis(diethylamino)-1,3,5-triazin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[4,6-bis(diethylamino)-s-triazin-2-yl]piperazine-1-carboxylic acid (2-isobutoxy-1,3-diketo-pyrrolizidin-8-yl)methyl ester Formula: C28H46N8O5 MolecularWeight: 574.71544

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=NC(=N1)N2CCN(CC2)C(=O)OCC34CCCN3C(=O)C(C4=O)OCC(C)C)N(CC)CC

Isomeric SMILES

CCN(CC)C1=NC(=NC(=N1)N2CCN(CC2)C(=O)OCC34CCCN3C(=O)C(C4=O)OCC(C)C)N(CC)CC

InChI

InChI=1S/C28H46N8O5/c1-7-32(8-2)24-29-25(33(9-3)10-4)31-26(30-24)34-14-16-35(17-15-34)27(39)41-19-28-12-11-13-36(28)23(38)21(22(28)37)40-18-20(5)6/h20-21H,7-19H2,1-6H3