ethyl 2-[5-(4-tert-butylphenyl)-1,3-dimethyl-2,4-bis(oxidanylidene)pyrrolo[3,4-d]pyrimidin-6-yl]ethanoate

Systemtic Name: ethyl 2-[5-(4-tert-butylphenyl)-1,3-dimethyl-2,4-bis(oxidanylidene)pyrrolo[3,4-d]pyrimidin-6-yl]ethanoate Openeye Name: ethyl 2-[5-(4-tert-butylphenyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[3,4-d]pyrimidin-6-yl]acetate CAS Name: 2-[5-(4-tert-butylphenyl)-1,3-dimethyl-2,4-dioxo-6-pyrrolo[3,4-d]pyrimidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(4-tert-butylphenyl)-1,3-dimethyl-2,4-dioxopyrrolo[3,4-d]pyrimidin-6-yl]acetate Traditional Name: 2-[5-(4-tert-butylphenyl)-2,4-diketo-1,3-dimethyl-pyrrolo[3,4-d]pyrimidin-6-yl]acetic acid ethyl ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C=C2C(=C1C3=CC=C(C=C3)C(C)(C)C)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCOC(=O)CN1C=C2C(=C1C3=CC=C(C=C3)C(C)(C)C)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C22H27N3O4/c1-7-29-17(26)13-25-12-16-18(20(27)24(6)21(28)23(16)5)19(25)14-8-10-15(11-9-14)22(2,3)4/h8-12H,7,13H2,1-6H3