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

Systemtic Name: tert-butyl N-(naphthalen-1-ylmethyl)-N-[2-(naphthalen-1-ylmethylamino)-6-phenethyl-pyrimidin-4-yl]carbamate Openeye Name: tert-butyl N-(1-naphthylmethyl)-N-[2-(1-naphthylmethylamino)-6-phenethyl-pyrimidin-4-yl]carbamate CAS Name: N-(1-naphthalenylmethyl)-N-[2-(1-naphthalenylmethylamino)-6-phenethyl-4-pyrimidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(naphthalen-1-ylmethyl)-N-[2-(naphthalen-1-ylmethylamino)-6-phenethylpyrimidin-4-yl]carbamate Traditional Name: N-(1-naphthylmethyl)-N-[2-(1-naphthylmethylamino)-6-phenethyl-pyrimidin-4-yl]carbamic acid tert-butyl ester Formula: C39H38N4O2 MolecularWeight: 594.74462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1=CC=CC2=CC=CC=C21)C3=NC(=NC(=C3)CCC4=CC=CC=C4)NCC5=CC=CC6=CC=CC=C65

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1=CC=CC2=CC=CC=C21)C3=NC(=NC(=C3)CCC4=CC=CC=C4)NCC5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C39H38N4O2/c1-39(2,3)45-38(44)43(27-32-20-12-18-30-16-8-10-22-35(30)32)36-25-33(24-23-28-13-5-4-6-14-28)41-37(42-36)40-26-31-19-11-17-29-15-7-9-21-34(29)31/h4-22,25H,23-24,26-27H2,1-3H3,(H,40,41,42)