6-[2-(fluoranylmethyl)-6-methylsulfonyl-phenoxy]-N-(1-methylpyrazol-3-yl)quinazolin-4-amine

Systemtic Name: 6-[2-(fluoranylmethyl)-6-methylsulfonyl-phenoxy]-N-(1-methylpyrazol-3-yl)quinazolin-4-amine Openeye Name: 6-[2-(fluoromethyl)-6-methylsulfonyl-phenoxy]-N-(1-methylpyrazol-3-yl)quinazolin-4-amine CAS Name: 6-[2-(fluoromethyl)-6-methylsulfonylphenoxy]-N-(1-methyl-3-pyrazolyl)-4-quinazolinamine IUPAC Name: 6-[2-(fluoromethyl)-6-methylsulfonylphenoxy]-N-(1-methylpyrazol-3-yl)quinazolin-4-amine Traditional Name: [6-[2-(fluoromethyl)-6-mesyl-phenoxy]quinazolin-4-yl]-(1-methylpyrazol-3-yl)amine Formula: C20H18FN5O3S MolecularWeight: 427.452023

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC2=NC=NC3=C2C=C(C=C3)OC4=C(C=CC=C4S(=O)(=O)C)CF

Isomeric SMILES

CN1C=CC(=N1)NC2=NC=NC3=C2C=C(C=C3)OC4=C(C=CC=C4S(=O)(=O)C)CF

InChI

InChI=1S/C20H18FN5O3S/c1-26-9-8-18(25-26)24-20-15-10-14(6-7-16(15)22-12-23-20)29-19-13(11-21)4-3-5-17(19)30(2,27)28/h3-10,12H,11H2,1-2H3,(H,22,23,24,25)