2-[1-(7-chloranyl-3-ethyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]-6-(trifluoromethyl)pyrimidin-4-amine

Systemtic Name: 2-[1-(7-chloranyl-3-ethyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]-6-(trifluoromethyl)pyrimidin-4-amine Openeye Name: 2-[1-(7-chloro-3-ethyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]-6-(trifluoromethyl)pyrimidin-4-amine CAS Name: 2-[1-(7-chloro-3-ethyl-1-methyl-5-pyrrolo[2,3-c]pyridinyl)ethylthio]-6-(trifluoromethyl)-4-pyrimidinamine IUPAC Name: 2-[1-(7-chloro-3-ethyl-1-methylpyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]-6-(trifluoromethyl)pyrimidin-4-amine Traditional Name: [2-[1-(7-chloro-3-ethyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylthio]-6-(trifluoromethyl)pyrimidin-4-yl]amine Formula: C17H17ClF3N5S MolecularWeight: 415.86359

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C2=C(N=C(C=C12)C(C)SC3=NC(=CC(=N3)N)C(F)(F)F)Cl)C

Isomeric SMILES

CCC1=CN(C2=C(N=C(C=C12)C(C)SC3=NC(=CC(=N3)N)C(F)(F)F)Cl)C

InChI

InChI=1S/C17H17ClF3N5S/c1-4-9-7-26(3)14-10(9)5-11(23-15(14)18)8(2)27-16-24-12(17(19,20)21)6-13(22)25-16/h5-8H,4H2,1-3H3,(H2,22,24,25)