N-(5-tert-butyl-2-methoxy-phenyl)-2-[4-[[2-(cyclopropylamino)pyrimidin-4-yl]amino]naphthalen-1-yl]-2-oxidanylidene-ethanamide

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)-2-[4-[[2-(cyclopropylamino)pyrimidin-4-yl]amino]naphthalen-1-yl]-2-oxidanylidene-ethanamide Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)-2-[4-[[2-(cyclopropylamino)pyrimidin-4-yl]amino]-1-naphthyl]-2-oxo-acetamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-2-[4-[[2-(cyclopropylamino)-4-pyrimidinyl]amino]-1-naphthalenyl]-2-oxoacetamide IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-2-[4-[[2-(cyclopropylamino)pyrimidin-4-yl]amino]naphthalen-1-yl]-2-oxoacetamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-2-[4-[[2-(cyclopropylamino)pyrimidin-4-yl]amino]-1-naphthyl]-2-keto-acetamide Formula: C30H31N5O3 MolecularWeight: 509.59884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C(=O)C2=CC=C(C3=CC=CC=C32)NC4=NC(=NC=C4)NC5CC5

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C(=O)C2=CC=C(C3=CC=CC=C32)NC4=NC(=NC=C4)NC5CC5

InChI

InChI=1S/C30H31N5O3/c1-30(2,3)18-9-14-25(38-4)24(17-18)34-28(37)27(36)22-12-13-23(21-8-6-5-7-20(21)22)33-26-15-16-31-29(35-26)32-19-10-11-19/h5-9,12-17,19H,10-11H2,1-4H3,(H,34,37)(H2,31,32,33,35)