4-cyclopropyl-6-methyl-N-phenyl-pyrimidin-2-amine; 1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 4-cyclopropyl-6-methyl-N-phenyl-pyrimidin-2-amine; 1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: 4-cyclopropyl-6-methyl-N-phenyl-pyrimidin-2-amine; N-[2-(1,3-dimethylbutyl)-3-thienyl]-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 4-cyclopropyl-6-methyl-N-phenyl-2-pyrimidinamine; 1-methyl-N-[2-(4-methylpentan-2-yl)-3-thiophenyl]-3-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine; 1-methyl-N-[2-(4-methylpentan-2-yl)thiophen-3-yl]-3-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: (4-cyclopropyl-6-methyl-pyrimidin-2-yl)-phenyl-amine; N-[2-(1,3-dimethylbutyl)-3-thienyl]-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide Formula: C30H35F3N6OS MolecularWeight: 584.69871

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2CC2)NC3=CC=CC=C3.CC(C)CC(C)C1=C(C=CS1)NC(=O)C2=CN(N=C2C(F)(F)F)C

Isomeric SMILES

CC1=NC(=NC(=C1)C2CC2)NC3=CC=CC=C3.CC(C)CC(C)C1=C(C=CS1)NC(=O)C2=CN(N=C2C(F)(F)F)C

InChI

InChI=1S/C16H20F3N3OS.C14H15N3/c1-9(2)7-10(3)13-12(5-6-24-13)20-15(23)11-8-22(4)21-14(11)16(17,18)19;1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h5-6,8-10H,7H2,1-4H3,(H,20,23);2-6,9,11H,7-8H2,1H3,(H,15,16,17)