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

Systemtic Name: N-[5-[1-(4-azanyl-6-methylsulfanyl-pyrimidin-2-yl)sulfanylethyl]-1H-pyrrolo[2,3-c]pyridin-3-yl]methanesulfonamide Openeye Name: N-[5-[1-(4-amino-6-methylsulfanyl-pyrimidin-2-yl)sulfanylethyl]-1H-pyrrolo[2,3-c]pyridin-3-yl]methanesulfonamide CAS Name: N-[5-[1-[[4-amino-6-(methylthio)-2-pyrimidinyl]thio]ethyl]-1H-pyrrolo[2,3-c]pyridin-3-yl]methanesulfonamide IUPAC Name: N-[5-[1-(4-amino-6-methylsulfanylpyrimidin-2-yl)sulfanylethyl]-1H-pyrrolo[2,3-c]pyridin-3-yl]methanesulfonamide Traditional Name: N-[5-[1-[[4-amino-6-(methylthio)pyrimidin-2-yl]thio]ethyl]-1H-pyrrolo[2,3-c]pyridin-3-yl]methanesulfonamide Formula: C15H18N6O2S3 MolecularWeight: 410.53742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=C2C(=C1)C(=CN2)NS(=O)(=O)C)SC3=NC(=CC(=N3)SC)N

Isomeric SMILES

CC(C1=NC=C2C(=C1)C(=CN2)NS(=O)(=O)C)SC3=NC(=CC(=N3)SC)N

InChI

InChI=1S/C15H18N6O2S3/c1-8(25-15-19-13(16)5-14(20-15)24-2)10-4-9-11(6-17-10)18-7-12(9)21-26(3,22)23/h4-8,18,21H,1-3H3,(H2,16,19,20)