ethyl N-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanoyl]carbamate

Systemtic Name: ethyl N-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanoyl]carbamate Openeye Name: ethyl N-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetyl]carbamate CAS Name: N-[1-oxo-2-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]ethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetyl]carbamate Traditional Name: N-[2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]acetyl]carbamic acid ethyl ester Formula: C16H15N5O3S MolecularWeight: 357.387

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)CSC1=NC=NC2=C1C=NN2C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)NC(=O)CSC1=NC=NC2=C1C=NN2C3=CC=CC=C3

InChI

InChI=1S/C16H15N5O3S/c1-2-24-16(23)20-13(22)9-25-15-12-8-19-21(14(12)17-10-18-15)11-6-4-3-5-7-11/h3-8,10H,2,9H2,1H3,(H,20,22,23)