N-(5-tert-butyl-3-cyano-2-methoxy-phenyl)-2-[4-[[2-(cyclopropylamino)pyrimidin-4-yl]amino]naphthalen-1-yl]-2-oxidanylidene-ethanamide

Systemtic Name: N-(5-tert-butyl-3-cyano-2-methoxy-phenyl)-2-[4-[[2-(cyclopropylamino)pyrimidin-4-yl]amino]naphthalen-1-yl]-2-oxidanylidene-ethanamide Openeye Name: N-(5-tert-butyl-3-cyano-2-methoxy-phenyl)-2-[4-[[2-(cyclopropylamino)pyrimidin-4-yl]amino]-1-naphthyl]-2-oxo-acetamide CAS Name: N-(5-tert-butyl-3-cyano-2-methoxyphenyl)-2-[4-[[2-(cyclopropylamino)-4-pyrimidinyl]amino]-1-naphthalenyl]-2-oxoacetamide IUPAC Name: N-(5-tert-butyl-3-cyano-2-methoxyphenyl)-2-[4-[[2-(cyclopropylamino)pyrimidin-4-yl]amino]naphthalen-1-yl]-2-oxoacetamide Traditional Name: N-(5-tert-butyl-3-cyano-2-methoxy-phenyl)-2-[4-[[2-(cyclopropylamino)pyrimidin-4-yl]amino]-1-naphthyl]-2-keto-acetamide Formula: C31H30N6O3 MolecularWeight: 534.6083

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C31H30N6O3/c1-31(2,3)19-15-18(17-32)28(40-4)25(16-19)36-29(39)27(38)23-11-12-24(22-8-6-5-7-21(22)23)35-26-13-14-33-30(37-26)34-20-9-10-20/h5-8,11-16,20H,9-10H2,1-4H3,(H,36,39)(H2,33,34,35,37)