N,4-dimethyl-N-[2-(octanoylamino)-4-oxidanylidene-1,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl]benzamide

Systemtic Name: N,4-dimethyl-N-[2-(octanoylamino)-4-oxidanylidene-1,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl]benzamide Openeye Name: N,4-dimethyl-N-[2-(octanoylamino)-4-oxo-1,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl]benzamide CAS Name: N,4-dimethyl-N-[4-oxo-2-(1-oxooctylamino)-1,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl]benzamide IUPAC Name: N,4-dimethyl-N-[2-(octanoylamino)-4-oxo-1,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl]benzamide Traditional Name: N-[2-(caprylylamino)-4-keto-1,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl]-N,4-dimethyl-benzamide Formula: C23H29N5O3 MolecularWeight: 423.50806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=NC(=O)C2=C(N1)NC=C2N(C)C(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCCC(=O)NC1=NC(=O)C2=C(N1)NC=C2N(C)C(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H29N5O3/c1-4-5-6-7-8-9-18(29)25-23-26-20-19(21(30)27-23)17(14-24-20)28(3)22(31)16-12-10-15(2)11-13-16/h10-14H,4-9H2,1-3H3,(H3,24,25,26,27,29,30)