tert-butyl N-[6-(3-methylbutyl)-2-(2-methylpropylamino)pyrimidin-4-yl]-N-(naphthalen-1-ylmethyl)carbamate

Systemtic Name: tert-butyl N-[6-(3-methylbutyl)-2-(2-methylpropylamino)pyrimidin-4-yl]-N-(naphthalen-1-ylmethyl)carbamate Openeye Name: tert-butyl N-[2-(isobutylamino)-6-isopentyl-pyrimidin-4-yl]-N-(1-naphthylmethyl)carbamate CAS Name: N-[6-(3-methylbutyl)-2-(2-methylpropylamino)-4-pyrimidinyl]-N-(1-naphthalenylmethyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[6-(3-methylbutyl)-2-(2-methylpropylamino)pyrimidin-4-yl]-N-(naphthalen-1-ylmethyl)carbamate Traditional Name: N-[6-isoamyl-2-(isobutylamino)pyrimidin-4-yl]-N-(1-naphthylmethyl)carbamic acid tert-butyl ester Formula: C29H40N4O2 MolecularWeight: 476.6535

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=CC(=NC(=N1)NCC(C)C)N(CC2=CC=CC3=CC=CC=C32)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CCC1=CC(=NC(=N1)NCC(C)C)N(CC2=CC=CC3=CC=CC=C32)C(=O)OC(C)(C)C

InChI

InChI=1S/C29H40N4O2/c1-20(2)15-16-24-17-26(32-27(31-24)30-18-21(3)4)33(28(34)35-29(5,6)7)19-23-13-10-12-22-11-8-9-14-25(22)23/h8-14,17,20-21H,15-16,18-19H2,1-7H3,(H,30,31,32)