ethyl 4-[3-(4-oxidanylidene-2-phenyl-1H-pyrrolo[2,3-d]pyrimidin-7-yl)propylamino]benzoate

Systemtic Name: ethyl 4-[3-(4-oxidanylidene-2-phenyl-1H-pyrrolo[2,3-d]pyrimidin-7-yl)propylamino]benzoate Openeye Name: ethyl 4-[3-(4-oxo-2-phenyl-1H-pyrrolo[2,3-d]pyrimidin-7-yl)propylamino]benzoate CAS Name: 4-[3-(4-oxo-2-phenyl-1H-pyrrolo[2,3-d]pyrimidin-7-yl)propylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-oxo-2-phenyl-1H-pyrrolo[2,3-d]pyrimidin-7-yl)propylamino]benzoate Traditional Name: 4-[3-(4-keto-2-phenyl-1H-pyrrolo[2,3-d]pyrimidin-7-yl)propylamino]benzoic acid ethyl ester Formula: C24H24N4O3 MolecularWeight: 416.47236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NCCCN2C=CC3=C2NC(=NC3=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NCCCN2C=CC3=C2NC(=NC3=O)C4=CC=CC=C4

InChI

InChI=1S/C24H24N4O3/c1-2-31-24(30)18-9-11-19(12-10-18)25-14-6-15-28-16-13-20-22(28)26-21(27-23(20)29)17-7-4-3-5-8-17/h3-5,7-13,16,25H,2,6,14-15H2,1H3,(H,26,27,29)