1-(3-methyl-1-benzothiophen-2-yl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(3-methyl-1-benzothiophen-2-yl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-(3-methylbenzothiophen-2-yl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanone CAS Name: 1-(3-methyl-1-benzothiophen-2-yl)-2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]ethanone IUPAC Name: 1-(3-methyl-1-benzothiophen-2-yl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanone Traditional Name: 1-(3-methylbenzothiophen-2-yl)-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]ethanone Formula: C17H14N4OS2 MolecularWeight: 354.44926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)CSC3=NC=NC4=C3C=NN4C

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)CSC3=NC=NC4=C3C=NN4C

InChI

InChI=1S/C17H14N4OS2/c1-10-11-5-3-4-6-14(11)24-15(10)13(22)8-23-17-12-7-20-21(2)16(12)18-9-19-17/h3-7,9H,8H2,1-2H3