4-azanyl-7-[(4-tert-butylphenyl)methyl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-7-[(4-tert-butylphenyl)methyl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Openeye Name: 4-amino-7-[(4-tert-butylphenyl)methyl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile CAS Name: 4-amino-7-[(4-tert-butylphenyl)methyl]-5-pyrrolo[2,3-d]pyrimidinecarbonitrile IUPAC Name: 4-amino-7-[(4-tert-butylphenyl)methyl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile Traditional Name: 4-amino-7-(4-tert-butylbenzyl)pyrrolo[2,3-d]pyrimidine-5-carbonitrile Formula: C18H19N5 MolecularWeight: 305.37696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C=C(C3=C2N=CN=C3N)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C=C(C3=C2N=CN=C3N)C#N

InChI

InChI=1S/C18H19N5/c1-18(2,3)14-6-4-12(5-7-14)9-23-10-13(8-19)15-16(20)21-11-22-17(15)23/h4-7,10-11H,9H2,1-3H3,(H2,20,21,22)