ethyl 2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]furan-3-carboxylate

Systemtic Name: ethyl 2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]furan-3-carboxylate Openeye Name: ethyl 2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]furan-3-carboxylate CAS Name: 2-[[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]methyl]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]furan-3-carboxylate Traditional Name: 2-[[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]methyl]furan-3-carboxylic acid ethyl ester Formula: C19H16N4O3S MolecularWeight: 380.42034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC=C1)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(OC=C1)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4

InChI

InChI=1S/C19H16N4O3S/c1-2-25-19(24)14-8-9-26-16(14)11-27-18-15-10-22-23(17(15)20-12-21-18)13-6-4-3-5-7-13/h3-10,12H,2,11H2,1H3