7-tert-butyl-5-[4-(3-chloranylphenoxy)-3-methyl-phenyl]pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 7-tert-butyl-5-[4-(3-chloranylphenoxy)-3-methyl-phenyl]pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 7-tert-butyl-5-[4-(3-chlorophenoxy)-3-methyl-phenyl]pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 7-tert-butyl-5-[4-(3-chlorophenoxy)-3-methylphenyl]-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 7-tert-butyl-5-[4-(3-chlorophenoxy)-3-methylphenyl]pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [7-tert-butyl-5-[4-(3-chlorophenoxy)-3-methyl-phenyl]pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C23H23ClN4O MolecularWeight: 406.90792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CN(C3=C2C(=NC=N3)N)C(C)(C)C)OC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CN(C3=C2C(=NC=N3)N)C(C)(C)C)OC4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H23ClN4O/c1-14-10-15(8-9-19(14)29-17-7-5-6-16(24)11-17)18-12-28(23(2,3)4)22-20(18)21(25)26-13-27-22/h5-13H,1-4H3,(H2,25,26,27)