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

Systemtic Name: 7-tert-butyl-5-[4-(phenylsulfinyl)phenyl]pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 5-[4-(benzenesulfinyl)phenyl]-7-tert-butyl-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 5-[4-(benzenesulfinyl)phenyl]-7-tert-butyl-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 5-[4-(benzenesulfinyl)phenyl]-7-tert-butylpyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [5-[4-(benzenesulfinyl)phenyl]-7-tert-butyl-pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C2=C1N=CN=C2N)C3=CC=C(C=C3)S(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)N1C=C(C2=C1N=CN=C2N)C3=CC=C(C=C3)S(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H22N4OS/c1-22(2,3)26-13-18(19-20(23)24-14-25-21(19)26)15-9-11-17(12-10-15)28(27)16-7-5-4-6-8-16/h4-14H,1-3H3,(H2,23,24,25)