tert-butyl N-[2-(naphthalen-1-ylmethylamino)-6-phenethyl-pyrimidin-4-yl]-N-(phenylmethyl)carbamate

Systemtic Name: tert-butyl N-[2-(naphthalen-1-ylmethylamino)-6-phenethyl-pyrimidin-4-yl]-N-(phenylmethyl)carbamate Openeye Name: tert-butyl N-benzyl-N-[2-(1-naphthylmethylamino)-6-phenethyl-pyrimidin-4-yl]carbamate CAS Name: N-[2-(1-naphthalenylmethylamino)-6-phenethyl-4-pyrimidinyl]-N-(phenylmethyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-benzyl-N-[2-(naphthalen-1-ylmethylamino)-6-phenethylpyrimidin-4-yl]carbamate Traditional Name: N-benzyl-N-[2-(1-naphthylmethylamino)-6-phenethyl-pyrimidin-4-yl]carbamic acid tert-butyl ester Formula: C35H36N4O2 MolecularWeight: 544.68594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)C2=NC(=NC(=C2)CCC3=CC=CC=C3)NCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)C2=NC(=NC(=C2)CCC3=CC=CC=C3)NCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C35H36N4O2/c1-35(2,3)41-34(40)39(25-27-15-8-5-9-16-27)32-23-30(22-21-26-13-6-4-7-14-26)37-33(38-32)36-24-29-19-12-18-28-17-10-11-20-31(28)29/h4-20,23H,21-22,24-25H2,1-3H3,(H,36,37,38)