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

Systemtic Name: 4-azanyl-6-bromanyl-7-[(3-methylphenyl)methyl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Openeye Name: 4-amino-6-bromo-7-(m-tolylmethyl)pyrrolo[2,3-d]pyrimidine-5-carbonitrile CAS Name: 4-amino-6-bromo-7-[(3-methylphenyl)methyl]-5-pyrrolo[2,3-d]pyrimidinecarbonitrile IUPAC Name: 4-amino-6-bromo-7-[(3-methylphenyl)methyl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Traditional Name: 4-amino-6-bromo-7-(3-methylbenzyl)pyrrolo[2,3-d]pyrimidine-5-carbonitrile Formula: C15H12BrN5 MolecularWeight: 342.19328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C3=C(C(=C2Br)C#N)C(=NC=N3)N

Isomeric SMILES

CC1=CC(=CC=C1)CN2C3=C(C(=C2Br)C#N)C(=NC=N3)N

InChI

InChI=1S/C15H12BrN5/c1-9-3-2-4-10(5-9)7-21-13(16)11(6-17)12-14(18)19-8-20-15(12)21/h2-5,8H,7H2,1H3,(H2,18,19,20)