methyl 5-azanyl-4-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-7-methyl-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 5-azanyl-4-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-7-methyl-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 5-amino-4-[(2-ethoxy-2-oxo-ethyl)amino]-7-methyl-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-amino-4-[(2-ethoxy-2-oxoethyl)amino]-7-methyl-2-(methylthio)-6-pyrrolo[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-4-[(2-ethoxy-2-oxoethyl)amino]-7-methyl-2-methylsulfanylpyrrolo[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-amino-4-[(2-ethoxy-2-keto-ethyl)amino]-7-methyl-2-(methylthio)pyrrolo[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C14H19N5O4S MolecularWeight: 353.39676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC1=NC(=NC2=C1C(=C(N2C)C(=O)OC)N)SC

Isomeric SMILES

CCOC(=O)CNC1=NC(=NC2=C1C(=C(N2C)C(=O)OC)N)SC

InChI

InChI=1S/C14H19N5O4S/c1-5-23-7(20)6-16-11-8-9(15)10(13(21)22-3)19(2)12(8)18-14(17-11)24-4/h5-6,15H2,1-4H3,(H,16,17,18)