N-[4-(2-fluoranyl-3-methoxy-phenyl)-1,3-thiazol-2-yl]-4-(pyrimidin-4-ylamino)benzamide

Systemtic Name: N-[4-(2-fluoranyl-3-methoxy-phenyl)-1,3-thiazol-2-yl]-4-(pyrimidin-4-ylamino)benzamide Openeye Name: N-[4-(2-fluoro-3-methoxy-phenyl)thiazol-2-yl]-4-(pyrimidin-4-ylamino)benzamide CAS Name: N-[4-(2-fluoro-3-methoxyphenyl)-2-thiazolyl]-4-(4-pyrimidinylamino)benzamide IUPAC Name: N-[4-(2-fluoro-3-methoxyphenyl)-1,3-thiazol-2-yl]-4-(pyrimidin-4-ylamino)benzamide Traditional Name: N-[4-(2-fluoro-3-methoxy-phenyl)thiazol-2-yl]-4-(4-pyrimidylamino)benzamide Formula: C21H16FN5O2S MolecularWeight: 421.447443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1F)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)NC4=NC=NC=C4

Isomeric SMILES

COC1=CC=CC(=C1F)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)NC4=NC=NC=C4

InChI

InChI=1S/C21H16FN5O2S/c1-29-17-4-2-3-15(19(17)22)16-11-30-21(26-16)27-20(28)13-5-7-14(8-6-13)25-18-9-10-23-12-24-18/h2-12H,1H3,(H,23,24,25)(H,26,27,28)