6-bromanyl-7-[(4-methylphenyl)methyl]-4-oxidanylidene-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

Systemtic Name: 6-bromanyl-7-[(4-methylphenyl)methyl]-4-oxidanylidene-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile Openeye Name: 6-bromo-4-oxo-7-(p-tolylmethyl)-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile CAS Name: 6-bromo-7-[(4-methylphenyl)methyl]-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile IUPAC Name: 6-bromo-7-[(4-methylphenyl)methyl]-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile Traditional Name: 6-bromo-4-keto-7-(4-methylbenzyl)-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile Formula: C15H11BrN4O MolecularWeight: 343.17804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=C(C(=C2Br)C#N)C(=O)N=CN3

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=C(C(=C2Br)C#N)C(=O)N=CN3

InChI

InChI=1S/C15H11BrN4O/c1-9-2-4-10(5-3-9)7-20-13(16)11(6-17)12-14(20)18-8-19-15(12)21/h2-5,8H,7H2,1H3,(H,18,19,21)