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

Systemtic Name: 3-ethoxycarbonyl-5-oxidanylidene-1-[4-[pentyl(sulfino)amino]phenyl]-4H-pyrazole Openeye Name: 3-ethoxycarbonyl-5-oxo-1-[4-[pentyl(sulfino)amino]phenyl]-4H-pyrazole CAS Name: 3-ethoxycarbonyl-5-oxo-1-[4-[pentyl(sulfino)amino]phenyl]-4H-pyrazole IUPAC Name: 3-ethoxycarbonyl-5-oxo-1-[4-[pentyl(sulfino)amino]phenyl]-4H-pyrazole Traditional Name: 1-[4-[amyl(sulfino)amino]phenyl]-3-carbethoxy-5-keto-2-pyrazoline Formula: C17H23N3O5S MolecularWeight: 381.44662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O5S/c1-3-5-6-11-19(26(23)24)13-7-9-14(10-8-13)20-16(21)12-15(18-20)17(22)25-4-2/h7-10H,3-6,11-12H2,1-2H3,(H,23,24)