tert-butyl N-(2-methylpropyl)-N-[2-(2-methylpropylamino)-6-(2-naphthalen-1-ylethyl)pyrimidin-4-yl]carbamate

Systemtic Name: tert-butyl N-(2-methylpropyl)-N-[2-(2-methylpropylamino)-6-(2-naphthalen-1-ylethyl)pyrimidin-4-yl]carbamate Openeye Name: tert-butyl N-isobutyl-N-[2-(isobutylamino)-6-[2-(1-naphthyl)ethyl]pyrimidin-4-yl]carbamate CAS Name: N-(2-methylpropyl)-N-[2-(2-methylpropylamino)-6-[2-(1-naphthalenyl)ethyl]-4-pyrimidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(2-methylpropyl)-N-[2-(2-methylpropylamino)-6-(2-naphthalen-1-ylethyl)pyrimidin-4-yl]carbamate Traditional Name: N-isobutyl-N-[2-(isobutylamino)-6-[2-(1-naphthyl)ethyl]pyrimidin-4-yl]carbamic acid tert-butyl ester Formula: C29H40N4O2 MolecularWeight: 476.6535

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC(=CC(=N1)N(CC(C)C)C(=O)OC(C)(C)C)CCC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)CNC1=NC(=CC(=N1)N(CC(C)C)C(=O)OC(C)(C)C)CCC2=CC=CC3=CC=CC=C32

InChI

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