4-[[4-(tert-butylamino)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-N-methyl-benzamide

Systemtic Name: 4-[[4-(tert-butylamino)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-N-methyl-benzamide Openeye Name: 4-[[4-(tert-butylamino)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-N-methyl-benzamide CAS Name: 4-[[4-(tert-butylamino)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-N-methylbenzamide IUPAC Name: 4-[[4-(tert-butylamino)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-N-methylbenzamide Traditional Name: 4-[[4-(tert-butylamino)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-N-methyl-benzamide Formula: C18H22N6O MolecularWeight: 338.40688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC(=NC2=C1C=CN2)NC3=CC=C(C=C3)C(=O)NC

Isomeric SMILES

CC(C)(C)NC1=NC(=NC2=C1C=CN2)NC3=CC=C(C=C3)C(=O)NC

InChI

InChI=1S/C18H22N6O/c1-18(2,3)24-15-13-9-10-20-14(13)22-17(23-15)21-12-7-5-11(6-8-12)16(25)19-4/h5-10H,1-4H3,(H,19,25)(H3,20,21,22,23,24)