1-[(3R)-3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 1-[(3R)-3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 1-[(3R)-3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 1-[(3R)-3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl]-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 1-[(3R)-3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 1-[(3R)-3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl]-2-[4-(2-pyrimidyl)piperazino]ethanone Formula: C24H25N5OS MolecularWeight: 431.5532

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)N2C(CSC3=CC=CC=C32)C4=CC=CC=C4)C5=NC=CC=N5

Isomeric SMILES

C1CN(CCN1CC(=O)N2[C@@H](CSC3=CC=CC=C32)C4=CC=CC=C4)C5=NC=CC=N5

InChI

InChI=1S/C24H25N5OS/c30-23(17-27-13-15-28(16-14-27)24-25-11-6-12-26-24)29-20-9-4-5-10-22(20)31-18-21(29)19-7-2-1-3-8-19/h1-12,21H,13-18H2/t21-/m0/s1