4-[3-methyl-5-[[3-(trifluoromethyloxy)phenyl]amino]-1-benzothiophen-2-yl]pyrimidin-2-amine

Systemtic Name: 4-[3-methyl-5-[[3-(trifluoromethyloxy)phenyl]amino]-1-benzothiophen-2-yl]pyrimidin-2-amine Openeye Name: 4-[3-methyl-5-[3-(trifluoromethoxy)anilino]benzothiophen-2-yl]pyrimidin-2-amine CAS Name: 4-[3-methyl-5-[3-(trifluoromethoxy)anilino]-1-benzothiophen-2-yl]-2-pyrimidinamine IUPAC Name: 4-[3-methyl-5-[3-(trifluoromethoxy)anilino]-1-benzothiophen-2-yl]pyrimidin-2-amine Traditional Name: [2-(2-aminopyrimidin-4-yl)-3-methyl-benzothiophen-5-yl]-[3-(trifluoromethoxy)phenyl]amine Formula: C20H15F3N4OS MolecularWeight: 416.41951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)NC3=CC(=CC=C3)OC(F)(F)F)C4=NC(=NC=C4)N

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)NC3=CC(=CC=C3)OC(F)(F)F)C4=NC(=NC=C4)N

InChI

InChI=1S/C20H15F3N4OS/c1-11-15-10-13(26-12-3-2-4-14(9-12)28-20(21,22)23)5-6-17(15)29-18(11)16-7-8-25-19(24)27-16/h2-10,26H,1H3,(H2,24,25,27)