2-[1-(3-cyclopropyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]-6-(trifluoromethyl)pyrimidin-4-amine

Systemtic Name: 2-[1-(3-cyclopropyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]-6-(trifluoromethyl)pyrimidin-4-amine Openeye Name: 2-[1-(3-cyclopropyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]-6-(trifluoromethyl)pyrimidin-4-amine CAS Name: 2-[1-(3-cyclopropyl-1-methyl-5-pyrrolo[2,3-c]pyridinyl)ethylthio]-6-(trifluoromethyl)-4-pyrimidinamine IUPAC Name: 2-[1-(3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]-6-(trifluoromethyl)pyrimidin-4-amine Traditional Name: [2-[1-(3-cyclopropyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylthio]-6-(trifluoromethyl)pyrimidin-4-yl]amine Formula: C18H18F3N5S MolecularWeight: 393.42923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=C2C(=C1)C(=CN2C)C3CC3)SC4=NC(=CC(=N4)N)C(F)(F)F

Isomeric SMILES

CC(C1=NC=C2C(=C1)C(=CN2C)C3CC3)SC4=NC(=CC(=N4)N)C(F)(F)F

InChI

InChI=1S/C18H18F3N5S/c1-9(27-17-24-15(18(19,20)21)6-16(22)25-17)13-5-11-12(10-3-4-10)8-26(2)14(11)7-23-13/h5-10H,3-4H2,1-2H3,(H2,22,24,25)