7-tert-butyl-N-ethyl-2-[(4-methylphenyl)carbonylamino]pyrrolo[2,3-d]pyrimidine-5-carboxamide

Systemtic Name: 7-tert-butyl-N-ethyl-2-[(4-methylphenyl)carbonylamino]pyrrolo[2,3-d]pyrimidine-5-carboxamide Openeye Name: 7-tert-butyl-N-ethyl-2-[(4-methylbenzoyl)amino]pyrrolo[2,3-d]pyrimidine-5-carboxamide CAS Name: 7-tert-butyl-N-ethyl-2-[[(4-methylphenyl)-oxomethyl]amino]-5-pyrrolo[2,3-d]pyrimidinecarboxamide IUPAC Name: 7-tert-butyl-N-ethyl-2-[(4-methylbenzoyl)amino]pyrrolo[2,3-d]pyrimidine-5-carboxamide Traditional Name: 7-tert-butyl-N-ethyl-2-(p-toluoylamino)pyrrolo[2,3-d]pyrimidine-5-carboxamide Formula: C21H25N5O2 MolecularWeight: 379.4555

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CN(C2=NC(=NC=C12)NC(=O)C3=CC=C(C=C3)C)C(C)(C)C

Isomeric SMILES

CCNC(=O)C1=CN(C2=NC(=NC=C12)NC(=O)C3=CC=C(C=C3)C)C(C)(C)C

InChI

InChI=1S/C21H25N5O2/c1-6-22-19(28)16-12-26(21(3,4)5)17-15(16)11-23-20(24-17)25-18(27)14-9-7-13(2)8-10-14/h7-12H,6H2,1-5H3,(H,22,28)(H,23,24,25,27)