1-(5-naphthalen-2-yl-3-phenyl-3,4-dihydropyrazol-2-yl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanone

Systemtic Name: 1-(5-naphthalen-2-yl-3-phenyl-3,4-dihydropyrazol-2-yl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanone Openeye Name: 1-[5-(2-naphthyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-2-(1-phenyltetrazol-5-yl)sulfanyl-ethanone CAS Name: 1-[5-(2-naphthalenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-2-[(1-phenyl-5-tetrazolyl)thio]ethanone IUPAC Name: 1-(5-naphthalen-2-yl-3-phenyl-3,4-dihydropyrazol-2-yl)-2-(1-phenyltetrazol-5-yl)sulfanylethanone Traditional Name: 1-[3-(2-naphthyl)-5-phenyl-2-pyrazolin-1-yl]-2-[(1-phenyltetrazol-5-yl)thio]ethanone Formula: C28H22N6OS MolecularWeight: 490.57888

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC3=CC=CC=C3C=C2)C(=O)CSC4=NN=NN4C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1C(N(N=C1C2=CC3=CC=CC=C3C=C2)C(=O)CSC4=NN=NN4C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C28H22N6OS/c35-27(19-36-28-29-31-32-33(28)24-13-5-2-6-14-24)34-26(21-10-3-1-4-11-21)18-25(30-34)23-16-15-20-9-7-8-12-22(20)17-23/h1-17,26H,18-19H2