6-[2-[(3-ethynylphenyl)amino]pyrimidin-4-yl]oxy-N,2-dimethyl-1-benzofuran-3-carboxamide

Systemtic Name: 6-[2-[(3-ethynylphenyl)amino]pyrimidin-4-yl]oxy-N,2-dimethyl-1-benzofuran-3-carboxamide Openeye Name: 6-[2-(3-ethynylanilino)pyrimidin-4-yl]oxy-N,2-dimethyl-benzofuran-3-carboxamide CAS Name: 6-[[2-(3-ethynylanilino)-4-pyrimidinyl]oxy]-N,2-dimethyl-3-benzofurancarboxamide IUPAC Name: 6-[2-(3-ethynylanilino)pyrimidin-4-yl]oxy-N,2-dimethyl-1-benzofuran-3-carboxamide Traditional Name: 6-[2-(3-ethynylanilino)pyrimidin-4-yl]oxy-N,2-dimethyl-benzofuran-3-carboxamide Formula: C23H18N4O3 MolecularWeight: 398.41402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=C(C=C2)OC3=NC(=NC=C3)NC4=CC=CC(=C4)C#C)C(=O)NC

Isomeric SMILES

CC1=C(C2=C(O1)C=C(C=C2)OC3=NC(=NC=C3)NC4=CC=CC(=C4)C#C)C(=O)NC

InChI

InChI=1S/C23H18N4O3/c1-4-15-6-5-7-16(12-15)26-23-25-11-10-20(27-23)30-17-8-9-18-19(13-17)29-14(2)21(18)22(28)24-3/h1,5-13H,2-3H3,(H,24,28)(H,25,26,27)