2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-1-thiophen-2-yl-ethanone

Systemtic Name: 2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-1-thiophen-2-yl-ethanone Openeye Name: 2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-1-(2-thienyl)ethanone CAS Name: 2-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-1-thiophen-2-ylethanone IUPAC Name: 2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-1-thiophen-2-ylethanone Traditional Name: 2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]-1-(2-thienyl)ethanone Formula: C17H12N4OS2 MolecularWeight: 352.43338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC(=O)C4=CC=CS4

InChI

InChI=1S/C17H12N4OS2/c22-14(15-7-4-8-23-15)10-24-17-13-9-20-21(16(13)18-11-19-17)12-5-2-1-3-6-12/h1-9,11H,10H2