ethyl 2-[2-azanyl-7-(cyclohexylmethyl)-4-oxidanylidene-1H-pyrrolo[2,3-d]pyrimidin-6-yl]ethanoate

Systemtic Name: ethyl 2-[2-azanyl-7-(cyclohexylmethyl)-4-oxidanylidene-1H-pyrrolo[2,3-d]pyrimidin-6-yl]ethanoate Openeye Name: ethyl 2-[2-amino-7-(cyclohexylmethyl)-4-oxo-1H-pyrrolo[2,3-d]pyrimidin-6-yl]acetate CAS Name: 2-[2-amino-7-(cyclohexylmethyl)-4-oxo-1H-pyrrolo[2,3-d]pyrimidin-6-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-amino-7-(cyclohexylmethyl)-4-oxo-1H-pyrrolo[2,3-d]pyrimidin-6-yl]acetate Traditional Name: 2-[2-amino-7-(cyclohexylmethyl)-4-keto-1H-pyrrolo[2,3-d]pyrimidin-6-yl]acetic acid ethyl ester Formula: C17H24N4O3 MolecularWeight: 332.39746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC2=C(N1CC3CCCCC3)NC(=NC2=O)N

Isomeric SMILES

CCOC(=O)CC1=CC2=C(N1CC3CCCCC3)NC(=NC2=O)N

InChI

InChI=1S/C17H24N4O3/c1-2-24-14(22)9-12-8-13-15(19-17(18)20-16(13)23)21(12)10-11-6-4-3-5-7-11/h8,11H,2-7,9-10H2,1H3,(H3,18,19,20,23)