6-(2-azanylpyrimidin-4-yl)oxy-N-(3-propan-2-ylphenyl)-1-benzothiophene-3-carboxamide

Systemtic Name: 6-(2-azanylpyrimidin-4-yl)oxy-N-(3-propan-2-ylphenyl)-1-benzothiophene-3-carboxamide Openeye Name: 6-(2-aminopyrimidin-4-yl)oxy-N-(3-isopropylphenyl)benzothiophene-3-carboxamide CAS Name: 6-[(2-amino-4-pyrimidinyl)oxy]-N-(3-propan-2-ylphenyl)-1-benzothiophene-3-carboxamide IUPAC Name: 6-(2-aminopyrimidin-4-yl)oxy-N-(3-propan-2-ylphenyl)-1-benzothiophene-3-carboxamide Traditional Name: 6-(2-aminopyrimidin-4-yl)oxy-N-m-cumenyl-benzothiophene-3-carboxamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)NC(=O)C2=CSC3=C2C=CC(=C3)OC4=NC(=NC=C4)N

Isomeric SMILES

CC(C)C1=CC(=CC=C1)NC(=O)C2=CSC3=C2C=CC(=C3)OC4=NC(=NC=C4)N

InChI

InChI=1S/C22H20N4O2S/c1-13(2)14-4-3-5-15(10-14)25-21(27)18-12-29-19-11-16(6-7-17(18)19)28-20-8-9-24-22(23)26-20/h3-13H,1-2H3,(H,25,27)(H2,23,24,26)