2-[1-(6-methoxypyridin-3-yl)-5-phenyl-pyrazol-3-yl]-5-methyl-1,2,5-thiadiazepane 1,1-dioxide

Systemtic Name: 2-[1-(6-methoxypyridin-3-yl)-5-phenyl-pyrazol-3-yl]-5-methyl-1,2,5-thiadiazepane 1,1-dioxide Openeye Name: 2-[1-(6-methoxy-3-pyridyl)-5-phenyl-pyrazol-3-yl]-5-methyl-1,2,5-thiadiazepane 1,1-dioxide CAS Name: 2-[1-(6-methoxy-3-pyridinyl)-5-phenyl-3-pyrazolyl]-5-methyl-1,2,5-thiadiazepane 1,1-dioxide IUPAC Name: 2-[1-(6-methoxypyridin-3-yl)-5-phenylpyrazol-3-yl]-5-methyl-1,2,5-thiadiazepane 1,1-dioxide Traditional Name: 2-[1-(6-methoxy-3-pyridyl)-5-phenyl-pyrazol-3-yl]-5-methyl-1,2,5-thiadiazepane 1,1-dioxide Formula: C20H23N5O3S MolecularWeight: 413.49332

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(S(=O)(=O)CC1)C2=NN(C(=C2)C3=CC=CC=C3)C4=CN=C(C=C4)OC

Isomeric SMILES

CN1CCN(S(=O)(=O)CC1)C2=NN(C(=C2)C3=CC=CC=C3)C4=CN=C(C=C4)OC

InChI

InChI=1S/C20H23N5O3S/c1-23-10-11-24(29(26,27)13-12-23)19-14-18(16-6-4-3-5-7-16)25(22-19)17-8-9-20(28-2)21-15-17/h3-9,14-15H,10-13H2,1-2H3