(phenylmethyl) 4-[4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-6-(phenethylamino)-1,3,5-triazin-2-yl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-6-(phenethylamino)-1,3,5-triazin-2-yl]piperazine-1-carboxylate Openeye Name: benzyl 4-[4-(4-tert-butoxycarbonylpiperazin-1-yl)-6-(phenethylamino)-1,3,5-triazin-2-yl]piperazine-1-carboxylate CAS Name: 4-[4-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]-6-(phenethylamino)-1,3,5-triazin-2-yl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-6-(phenethylamino)-1,3,5-triazin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[4-(4-tert-butoxycarbonylpiperazino)-6-(phenethylamino)-s-triazin-2-yl]piperazine-1-carboxylic acid benzyl ester Formula: C32H42N8O4 MolecularWeight: 602.72708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=NC(=N2)N3CCN(CC3)C(=O)OCC4=CC=CC=C4)NCCC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=NC(=N2)N3CCN(CC3)C(=O)OCC4=CC=CC=C4)NCCC5=CC=CC=C5

InChI

InChI=1S/C32H42N8O4/c1-32(2,3)44-31(42)40-22-18-38(19-23-40)29-35-27(33-15-14-25-10-6-4-7-11-25)34-28(36-29)37-16-20-39(21-17-37)30(41)43-24-26-12-8-5-9-13-26/h4-13H,14-24H2,1-3H3,(H,33,34,35,36)