4-[3,5-dicyclopropyl-1-(methylsulfonylmethyl)pyrazol-4-yl]oxynaphthalene-1-carbonitrile

Systemtic Name: 4-[3,5-dicyclopropyl-1-(methylsulfonylmethyl)pyrazol-4-yl]oxynaphthalene-1-carbonitrile Openeye Name: 4-[3,5-dicyclopropyl-1-(methylsulfonylmethyl)pyrazol-4-yl]oxynaphthalene-1-carbonitrile CAS Name: 4-[[3,5-dicyclopropyl-1-(methylsulfonylmethyl)-4-pyrazolyl]oxy]-1-naphthalenecarbonitrile IUPAC Name: 4-[3,5-dicyclopropyl-1-(methylsulfonylmethyl)pyrazol-4-yl]oxynaphthalene-1-carbonitrile Traditional Name: 4-[3,5-dicyclopropyl-1-(mesylmethyl)pyrazol-4-yl]oxynaphthalene-1-carbonitrile Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CN1C(=C(C(=N1)C2CC2)OC3=CC=C(C4=CC=CC=C43)C#N)C5CC5

Isomeric SMILES

CS(=O)(=O)CN1C(=C(C(=N1)C2CC2)OC3=CC=C(C4=CC=CC=C43)C#N)C5CC5

InChI

InChI=1S/C22H21N3O3S/c1-29(26,27)13-25-21(15-8-9-15)22(20(24-25)14-6-7-14)28-19-11-10-16(12-23)17-4-2-3-5-18(17)19/h2-5,10-11,14-15H,6-9,13H2,1H3