methyl 5-[1-(4-azanyl-6-methylsulfanyl-pyrimidin-2-yl)sulfanylethyl]-1-methyl-pyrrolo[2,3-c]pyridine-3-carboxylate

Systemtic Name: methyl 5-[1-(4-azanyl-6-methylsulfanyl-pyrimidin-2-yl)sulfanylethyl]-1-methyl-pyrrolo[2,3-c]pyridine-3-carboxylate Openeye Name: methyl 5-[1-(4-amino-6-methylsulfanyl-pyrimidin-2-yl)sulfanylethyl]-1-methyl-pyrrolo[2,3-c]pyridine-3-carboxylate CAS Name: 5-[1-[[4-amino-6-(methylthio)-2-pyrimidinyl]thio]ethyl]-1-methyl-3-pyrrolo[2,3-c]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[1-(4-amino-6-methylsulfanylpyrimidin-2-yl)sulfanylethyl]-1-methylpyrrolo[2,3-c]pyridine-3-carboxylate Traditional Name: 5-[1-[[4-amino-6-(methylthio)pyrimidin-2-yl]thio]ethyl]-1-methyl-pyrrolo[2,3-c]pyridine-3-carboxylic acid methyl ester Formula: C17H19N5O2S2 MolecularWeight: 389.49506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=C2C(=C1)C(=CN2C)C(=O)OC)SC3=NC(=CC(=N3)SC)N

Isomeric SMILES

CC(C1=NC=C2C(=C1)C(=CN2C)C(=O)OC)SC3=NC(=CC(=N3)SC)N

InChI

InChI=1S/C17H19N5O2S2/c1-9(26-17-20-14(18)6-15(21-17)25-4)12-5-10-11(16(23)24-3)8-22(2)13(10)7-19-12/h5-9H,1-4H3,(H2,18,20,21)