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

Systemtic Name: 6-(2-azanylpyrimidin-4-yl)oxy-N-(3-cyclopropylphenyl)-1-benzothiophene-3-carboxamide Openeye Name: 6-(2-aminopyrimidin-4-yl)oxy-N-(3-cyclopropylphenyl)benzothiophene-3-carboxamide CAS Name: 6-[(2-amino-4-pyrimidinyl)oxy]-N-(3-cyclopropylphenyl)-1-benzothiophene-3-carboxamide IUPAC Name: 6-(2-aminopyrimidin-4-yl)oxy-N-(3-cyclopropylphenyl)-1-benzothiophene-3-carboxamide Traditional Name: 6-(2-aminopyrimidin-4-yl)oxy-N-(3-cyclopropylphenyl)benzothiophene-3-carboxamide Formula: C22H18N4O2S MolecularWeight: 402.46892

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=CC=C2)NC(=O)C3=CSC4=C3C=CC(=C4)OC5=NC(=NC=C5)N

Isomeric SMILES

C1CC1C2=CC(=CC=C2)NC(=O)C3=CSC4=C3C=CC(=C4)OC5=NC(=NC=C5)N

InChI

InChI=1S/C22H18N4O2S/c23-22-24-9-8-20(26-22)28-16-6-7-17-18(12-29-19(17)11-16)21(27)25-15-3-1-2-14(10-15)13-4-5-13/h1-3,6-13H,4-5H2,(H,25,27)(H2,23,24,26)