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

Systemtic Name: N-[5-[1-(4-azanyl-6-cyano-pyrimidin-2-yl)sulfanylethyl]-1-methyl-pyrrolo[2,3-c]pyridin-3-yl]methanesulfonamide Openeye Name: N-[5-[1-(4-amino-6-cyano-pyrimidin-2-yl)sulfanylethyl]-1-methyl-pyrrolo[2,3-c]pyridin-3-yl]methanesulfonamide CAS Name: N-[5-[1-[(4-amino-6-cyano-2-pyrimidinyl)thio]ethyl]-1-methyl-3-pyrrolo[2,3-c]pyridinyl]methanesulfonamide IUPAC Name: N-[5-[1-(4-amino-6-cyanopyrimidin-2-yl)sulfanylethyl]-1-methylpyrrolo[2,3-c]pyridin-3-yl]methanesulfonamide Traditional Name: N-[5-[1-[(4-amino-6-cyano-pyrimidin-2-yl)thio]ethyl]-1-methyl-pyrrolo[2,3-c]pyridin-3-yl]methanesulfonamide Formula: C16H17N7O2S2 MolecularWeight: 403.48188

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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#N

Isomeric SMILES

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

InChI

InChI=1S/C16H17N7O2S2/c1-9(26-16-20-10(6-17)4-15(18)21-16)12-5-11-13(22-27(3,24)25)8-23(2)14(11)7-19-12/h4-5,7-9,22H,1-3H3,(H2,18,20,21)