3-(2-methoxyethoxycarbonyl)-5-oxidanylidene-1-[4-[pentyl(sulfino)amino]phenyl]-4H-pyrazole

Systemtic Name: 3-(2-methoxyethoxycarbonyl)-5-oxidanylidene-1-[4-[pentyl(sulfino)amino]phenyl]-4H-pyrazole Openeye Name: 3-(2-methoxyethoxycarbonyl)-5-oxo-1-[4-[pentyl(sulfino)amino]phenyl]-4H-pyrazole CAS Name: 3-[2-methoxyethoxy(oxo)methyl]-5-oxo-1-[4-[pentyl(sulfino)amino]phenyl]-4H-pyrazole IUPAC Name: 3-(2-methoxyethoxycarbonyl)-5-oxo-1-[4-[pentyl(sulfino)amino]phenyl]-4H-pyrazole Traditional Name: 1-[4-[amyl(sulfino)amino]phenyl]-5-keto-3-(2-methoxyethoxycarbonyl)-2-pyrazoline Formula: C18H25N3O6S MolecularWeight: 411.4726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=CC=C(C=C1)N2C(=O)CC(=N2)C(=O)OCCOC)S(=O)O

Isomeric SMILES

CCCCCN(C1=CC=C(C=C1)N2C(=O)CC(=N2)C(=O)OCCOC)S(=O)O

InChI

InChI=1S/C18H25N3O6S/c1-3-4-5-10-20(28(24)25)14-6-8-15(9-7-14)21-17(22)13-16(19-21)18(23)27-12-11-26-2/h6-9H,3-5,10-13H2,1-2H3,(H,24,25)