6-chloranyl-2-[1-[1-methyl-3-[2,2,2-tris(fluoranyl)ethyl]pyrrolo[2,3-c]pyridin-5-yl]ethylsulfanyl]pyrimidin-4-amine

Systemtic Name: 6-chloranyl-2-[1-[1-methyl-3-[2,2,2-tris(fluoranyl)ethyl]pyrrolo[2,3-c]pyridin-5-yl]ethylsulfanyl]pyrimidin-4-amine Openeye Name: 6-chloro-2-[1-[1-methyl-3-(2,2,2-trifluoroethyl)pyrrolo[2,3-c]pyridin-5-yl]ethylsulfanyl]pyrimidin-4-amine CAS Name: 6-chloro-2-[1-[1-methyl-3-(2,2,2-trifluoroethyl)-5-pyrrolo[2,3-c]pyridinyl]ethylthio]-4-pyrimidinamine IUPAC Name: 6-chloro-2-[1-[1-methyl-3-(2,2,2-trifluoroethyl)pyrrolo[2,3-c]pyridin-5-yl]ethylsulfanyl]pyrimidin-4-amine Traditional Name: [6-chloro-2-[1-[1-methyl-3-(2,2,2-trifluoroethyl)pyrrolo[2,3-c]pyridin-5-yl]ethylthio]pyrimidin-4-yl]amine Formula: C16H15ClF3N5S MolecularWeight: 401.83701

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=C2C(=C1)C(=CN2C)CC(F)(F)F)SC3=NC(=CC(=N3)Cl)N

Isomeric SMILES

CC(C1=NC=C2C(=C1)C(=CN2C)CC(F)(F)F)SC3=NC(=CC(=N3)Cl)N

InChI

InChI=1S/C16H15ClF3N5S/c1-8(26-15-23-13(17)4-14(21)24-15)11-3-10-9(5-16(18,19)20)7-25(2)12(10)6-22-11/h3-4,6-8H,5H2,1-2H3,(H2,21,23,24)