2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-1-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethanone

Systemtic Name: 2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-1-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethanone Openeye Name: 2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-1-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethanone CAS Name: 2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-1-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethanone IUPAC Name: 2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-1-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethanone Traditional Name: 2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]-1-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethanone Formula: C22H19N5OS2 MolecularWeight: 433.54916

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)N3C(CSC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)N3C(CSC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C22H19N5OS2/c1-26-21-16(11-25-26)22(24-14-23-21)30-13-20(28)27-17-9-5-6-10-19(17)29-12-18(27)15-7-3-2-4-8-15/h2-11,14,18H,12-13H2,1H3