3-[2-(2-azanylpyrimidin-5-yl)ethynyl]-N-[4-(2-dimethylaminoethyloxy)phenyl]-4-methyl-benzamide

Systemtic Name: 3-[2-(2-azanylpyrimidin-5-yl)ethynyl]-N-[4-(2-dimethylaminoethyloxy)phenyl]-4-methyl-benzamide Openeye Name: 3-[2-(2-aminopyrimidin-5-yl)ethynyl]-N-[4-(2-dimethylaminoethyloxy)phenyl]-4-methyl-benzamide CAS Name: 3-[2-(2-amino-5-pyrimidinyl)ethynyl]-N-[4-(2-dimethylaminoethyloxy)phenyl]-4-methylbenzamide IUPAC Name: 3-[2-(2-aminopyrimidin-5-yl)ethynyl]-N-[4-(2-dimethylaminoethyloxy)phenyl]-4-methylbenzamide Traditional Name: 3-[2-(2-aminopyrimidin-5-yl)ethynyl]-N-[4-(2-dimethylaminoethyloxy)phenyl]-4-methyl-benzamide Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)OCCN(C)C)C#CC3=CN=C(N=C3)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)OCCN(C)C)C#CC3=CN=C(N=C3)N

InChI

InChI=1S/C24H25N5O2/c1-17-4-6-20(14-19(17)7-5-18-15-26-24(25)27-16-18)23(30)28-21-8-10-22(11-9-21)31-13-12-29(2)3/h4,6,8-11,14-16H,12-13H2,1-3H3,(H,28,30)(H2,25,26,27)