N-tert-butyl-4-[(6-oxidanylidene-7-pentan-3-yl-5H-pyrrolo[2,3-d]pyrimidin-2-yl)amino]benzamide

Systemtic Name: N-tert-butyl-4-[(6-oxidanylidene-7-pentan-3-yl-5H-pyrrolo[2,3-d]pyrimidin-2-yl)amino]benzamide Openeye Name: N-tert-butyl-4-[[7-(1-ethylpropyl)-6-oxo-5H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzamide CAS Name: N-tert-butyl-4-[(6-oxo-7-pentan-3-yl-5H-pyrrolo[2,3-d]pyrimidin-2-yl)amino]benzamide IUPAC Name: N-tert-butyl-4-[(6-oxo-7-pentan-3-yl-5H-pyrrolo[2,3-d]pyrimidin-2-yl)amino]benzamide Traditional Name: N-tert-butyl-4-[[7-(1-ethylpropyl)-6-keto-5H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzamide Formula: C22H29N5O2 MolecularWeight: 395.49796

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C(=O)CC2=CN=C(N=C21)NC3=CC=C(C=C3)C(=O)NC(C)(C)C

Isomeric SMILES

CCC(CC)N1C(=O)CC2=CN=C(N=C21)NC3=CC=C(C=C3)C(=O)NC(C)(C)C

InChI

InChI=1S/C22H29N5O2/c1-6-17(7-2)27-18(28)12-15-13-23-21(25-19(15)27)24-16-10-8-14(9-11-16)20(29)26-22(3,4)5/h8-11,13,17H,6-7,12H2,1-5H3,(H,26,29)(H,23,24,25)