N-[4-azanylidene-1-[3-(4-methoxyphenyl)propyl]pyrazolo[3,4-d]pyrimidin-5-yl]furan-2-carboxamide

Systemtic Name: N-[4-azanylidene-1-[3-(4-methoxyphenyl)propyl]pyrazolo[3,4-d]pyrimidin-5-yl]furan-2-carboxamide Openeye Name: N-[4-imino-1-[3-(4-methoxyphenyl)propyl]pyrazolo[3,4-d]pyrimidin-5-yl]furan-2-carboxamide CAS Name: N-[4-imino-1-[3-(4-methoxyphenyl)propyl]-5-pyrazolo[3,4-d]pyrimidinyl]-2-furancarboxamide IUPAC Name: N-[4-imino-1-[3-(4-methoxyphenyl)propyl]pyrazolo[3,4-d]pyrimidin-5-yl]furan-2-carboxamide Traditional Name: N-[4-imino-1-[3-(4-methoxyphenyl)propyl]pyrazolo[3,4-d]pyrimidin-5-yl]-2-furamide Formula: C20H20N6O3 MolecularWeight: 392.4112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCN2C3=C(C=N2)C(=N)N(C=N3)NC(=O)C4=CC=CO4

Isomeric SMILES

COC1=CC=C(C=C1)CCCN2C3=C(C=N2)C(=N)N(C=N3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C20H20N6O3/c1-28-15-8-6-14(7-9-15)4-2-10-25-19-16(12-23-25)18(21)26(13-22-19)24-20(27)17-5-3-11-29-17/h3,5-9,11-13,21H,2,4,10H2,1H3,(H,24,27)