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

Systemtic Name: 4-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-1-thiophen-2-yl-butan-1-one Openeye Name: 4-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-1-(2-thienyl)butan-1-one CAS Name: 4-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-1-thiophen-2-yl-1-butanone IUPAC Name: 4-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-1-thiophen-2-ylbutan-1-one Traditional Name: 4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]-1-(2-thienyl)butan-1-one Formula: C19H16N4OS2 MolecularWeight: 380.48654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N4OS2/c24-16(17-9-5-10-25-17)8-4-11-26-19-15-12-22-23(18(15)20-13-21-19)14-6-2-1-3-7-14/h1-3,5-7,9-10,12-13H,4,8,11H2