2-(1,3-benzoxazol-2-ylsulfanyl)-1-(5-naphthalen-2-yl-3-phenyl-3,4-dihydropyrazol-2-yl)ethanone

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-(5-naphthalen-2-yl-3-phenyl-3,4-dihydropyrazol-2-yl)ethanone Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-[5-(2-naphthyl)-3-phenyl-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-(1,3-benzoxazol-2-ylthio)-1-[5-(2-naphthalenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-(5-naphthalen-2-yl-3-phenyl-3,4-dihydropyrazol-2-yl)ethanone Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-1-[3-(2-naphthyl)-5-phenyl-2-pyrazolin-1-yl]ethanone Formula: C28H21N3O2S MolecularWeight: 463.55024

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC3=CC=CC=C3C=C2)C(=O)CSC4=NC5=CC=CC=C5O4)C6=CC=CC=C6

Isomeric SMILES

C1C(N(N=C1C2=CC3=CC=CC=C3C=C2)C(=O)CSC4=NC5=CC=CC=C5O4)C6=CC=CC=C6

InChI

InChI=1S/C28H21N3O2S/c32-27(18-34-28-29-23-12-6-7-13-26(23)33-28)31-25(20-9-2-1-3-10-20)17-24(30-31)22-15-14-19-8-4-5-11-21(19)16-22/h1-16,25H,17-18H2