4-[[4-[(2E)-2-[(2,2-dimethyl-1,3-benzodioxol-5-yl)methylidene]hydrazinyl]-6-morpholin-4-yl-pyrimidin-2-yl]methyl]-N,N-dimethyl-piperazine-1-sulfonamide

Systemtic Name: 4-[[4-[(2E)-2-[(2,2-dimethyl-1,3-benzodioxol-5-yl)methylidene]hydrazinyl]-6-morpholin-4-yl-pyrimidin-2-yl]methyl]-N,N-dimethyl-piperazine-1-sulfonamide Openeye Name: 4-[[4-[(2E)-2-[(2,2-dimethyl-1,3-benzodioxol-5-yl)methylene]hydrazino]-6-morpholino-pyrimidin-2-yl]methyl]-N,N-dimethyl-piperazine-1-sulfonamide CAS Name: 4-[[4-[(2E)-2-[(2,2-dimethyl-1,3-benzodioxol-5-yl)methylidene]hydrazinyl]-6-(4-morpholinyl)-2-pyrimidinyl]methyl]-N,N-dimethyl-1-piperazinesulfonamide IUPAC Name: 4-[[4-[(2E)-2-[(2,2-dimethyl-1,3-benzodioxol-5-yl)methylidene]hydrazinyl]-6-morpholin-4-ylpyrimidin-2-yl]methyl]-N,N-dimethylpiperazine-1-sulfonamide Traditional Name: 4-[[4-[(N'E)-N'-[(2,2-dimethyl-1,3-benzodioxol-5-yl)methylene]hydrazino]-6-morpholino-pyrimidin-2-yl]methyl]-N,N-dimethyl-piperazine-1-sulfonamide Formula: C25H36N8O5S MolecularWeight: 560.66894

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2=C(O1)C=C(C=C2)C=NNC3=NC(=NC(=C3)N4CCOCC4)CN5CCN(CC5)S(=O)(=O)N(C)C)C

Isomeric SMILES

CC1(OC2=C(O1)C=C(C=C2)/C=N/NC3=NC(=NC(=C3)N4CCOCC4)CN5CCN(CC5)S(=O)(=O)N(C)C)C

InChI

InChI=1S/C25H36N8O5S/c1-25(2)37-20-6-5-19(15-21(20)38-25)17-26-29-22-16-24(32-11-13-36-14-12-32)28-23(27-22)18-31-7-9-33(10-8-31)39(34,35)30(3)4/h5-6,15-17H,7-14,18H2,1-4H3,(H,27,28,29)/b26-17+