N-[5-[1-[4-azanyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethyl]-1-methyl-pyrrolo[2,3-c]pyridin-3-yl]methanesulfonamide

Systemtic Name: N-[5-[1-[4-azanyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethyl]-1-methyl-pyrrolo[2,3-c]pyridin-3-yl]methanesulfonamide Openeye Name: N-[5-[1-[4-amino-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethyl]-1-methyl-pyrrolo[2,3-c]pyridin-3-yl]methanesulfonamide CAS Name: N-[5-[1-[[4-amino-6-(trifluoromethyl)-2-pyrimidinyl]thio]ethyl]-1-methyl-3-pyrrolo[2,3-c]pyridinyl]methanesulfonamide IUPAC Name: N-[5-[1-[4-amino-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethyl]-1-methylpyrrolo[2,3-c]pyridin-3-yl]methanesulfonamide Traditional Name: N-[5-[1-[[4-amino-6-(trifluoromethyl)pyrimidin-2-yl]thio]ethyl]-1-methyl-pyrrolo[2,3-c]pyridin-3-yl]methanesulfonamide Formula: C16H17F3N6O2S2 MolecularWeight: 446.47039

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17F3N6O2S2/c1-8(28-15-22-13(16(17,18)19)5-14(20)23-15)10-4-9-11(24-29(3,26)27)7-25(2)12(9)6-21-10/h4-8,24H,1-3H3,(H2,20,22,23)