tert-butyl N-[1-[4-[3,5-bis[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]-6-[[4-[(2-methoxy-6-oxidanyl-phenyl)carbonylamino]-3-phenylmethoxy-phenyl]amino]-1,3,5-triazin-2-yl]-5-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-3-yl]carbamate

Systemtic Name: tert-butyl N-[1-[4-[3,5-bis[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]-6-[[4-[(2-methoxy-6-oxidanyl-phenyl)carbonylamino]-3-phenylmethoxy-phenyl]amino]-1,3,5-triazin-2-yl]-5-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-3-yl]carbamate Openeye Name: tert-butyl N-[1-[4-[3-benzyloxy-4-[(2-hydroxy-6-methoxy-benzoyl)amino]anilino]-6-[3,5-bis(tert-butoxycarbonylamino)-1-piperidyl]-1,3,5-triazin-2-yl]-5-(tert-butoxycarbonylamino)-3-piperidyl]carbamate CAS Name: N-[1-[4-[3,5-bis[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-piperidinyl]-6-[4-[[(2-hydroxy-6-methoxyphenyl)-oxomethyl]amino]-3-phenylmethoxyanilino]-1,3,5-triazin-2-yl]-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-piperidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[4-[3,5-bis[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]-6-[4-[(2-hydroxy-6-methoxybenzoyl)amino]-3-phenylmethoxyanilino]-1,3,5-triazin-2-yl]-5-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-3-yl]carbamate Traditional Name: N-[1-[4-[3-benzoxy-4-[(2-hydroxy-6-methoxy-benzoyl)amino]anilino]-6-[3,5-bis(tert-butoxycarbonylamino)piperidino]-s-triazin-2-yl]-5-(tert-butoxycarbonylamino)-3-piperidyl]carbamic acid tert-butyl ester Formula: C54H75N11O12 MolecularWeight: 1070.2398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CC(CN(C1)C2=NC(=NC(=N2)NC3=CC(=C(C=C3)NC(=O)C4=C(C=CC=C4OC)O)OCC5=CC=CC=C5)N6CC(CC(C6)NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NC1CC(CN(C1)C2=NC(=NC(=N2)NC3=CC(=C(C=C3)NC(=O)C4=C(C=CC=C4OC)O)OCC5=CC=CC=C5)N6CC(CC(C6)NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C54H75N11O12/c1-51(2,3)74-47(68)56-34-24-35(57-48(69)75-52(4,5)6)28-64(27-34)45-61-44(62-46(63-45)65-29-36(58-49(70)76-53(7,8)9)25-37(30-65)59-50(71)77-54(10,11)12)55-33-22-23-38(41(26-33)73-31-32-18-15-14-16-19-32)60-43(67)42-39(66)20-17-21-40(42)72-13/h14-23,26,34-37,66H,24-25,27-31H2,1-13H3,(H,56,68)(H,57,69)(H,58,70)(H,59,71)(H,60,67)(H,55,61,62,63)