4-chloranyl-7-ethanoyl-6-methylsulfanyl-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

Systemtic Name: 4-chloranyl-7-ethanoyl-6-methylsulfanyl-pyrrolo[2,3-d]pyrimidine-5-carbonitrile Openeye Name: 7-acetyl-4-chloro-6-methylsulfanyl-pyrrolo[2,3-d]pyrimidine-5-carbonitrile CAS Name: 7-acetyl-4-chloro-6-(methylthio)-5-pyrrolo[2,3-d]pyrimidinecarbonitrile IUPAC Name: 7-acetyl-4-chloro-6-methylsulfanylpyrrolo[2,3-d]pyrimidine-5-carbonitrile Traditional Name: 7-acetyl-4-chloro-6-(methylthio)pyrrolo[2,3-d]pyrimidine-5-carbonitrile Formula: C10H7ClN4OS MolecularWeight: 266.70678

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=C(C(=C1SC)C#N)C(=NC=N2)Cl

Isomeric SMILES

CC(=O)N1C2=C(C(=C1SC)C#N)C(=NC=N2)Cl

InChI

InChI=1S/C10H7ClN4OS/c1-5(16)15-9-7(8(11)13-4-14-9)6(3-12)10(15)17-2/h4H,1-2H3