3-methyl-4-[4-oxidanylidene-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1-phenyl-pyrazolo[3,4-b][1,4]thiazin-5-one

Systemtic Name: 3-methyl-4-[4-oxidanylidene-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1-phenyl-pyrazolo[3,4-b][1,4]thiazin-5-one Openeye Name: 3-methyl-4-[4-oxo-4-[4-(2-pyridyl)piperazin-1-yl]butyl]-1-phenyl-pyrazolo[3,4-b][1,4]thiazin-5-one CAS Name: 3-methyl-4-[4-oxo-4-[4-(2-pyridinyl)-1-piperazinyl]butyl]-1-phenyl-5-pyrazolo[3,4-b][1,4]thiazinone IUPAC Name: 3-methyl-4-[4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1-phenylpyrazolo[3,4-b][1,4]thiazin-5-one Traditional Name: 4-[4-keto-4-[4-(2-pyridyl)piperazino]butyl]-3-methyl-1-phenyl-pyrazolo[3,4-b][1,4]thiazin-5-one Formula: C25H28N6O2S MolecularWeight: 476.59382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N(C(=O)CS2)CCCC(=O)N3CCN(CC3)C4=CC=CC=N4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1N(C(=O)CS2)CCCC(=O)N3CCN(CC3)C4=CC=CC=N4)C5=CC=CC=C5

InChI

InChI=1S/C25H28N6O2S/c1-19-24-25(31(27-19)20-8-3-2-4-9-20)34-18-23(33)30(24)13-7-11-22(32)29-16-14-28(15-17-29)21-10-5-6-12-26-21/h2-6,8-10,12H,7,11,13-18H2,1H3