1,5-dimethyl-4-[5-[(2R)-3-naphthalen-2-yloxy-2-oxidanyl-propyl]sulfanyl-1,2,3,4-tetrazol-1-yl]-2-phenyl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-4-[5-[(2R)-3-naphthalen-2-yloxy-2-oxidanyl-propyl]sulfanyl-1,2,3,4-tetrazol-1-yl]-2-phenyl-pyrazol-3-one Openeye Name: 4-[5-[(2R)-2-hydroxy-3-(2-naphthyloxy)propyl]sulfanyltetrazol-1-yl]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[5-[[(2R)-2-hydroxy-3-(2-naphthalenyloxy)propyl]thio]-1-tetrazolyl]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[5-[(2R)-2-hydroxy-3-naphthalen-2-yloxypropyl]sulfanyltetrazol-1-yl]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[5-[[(2R)-2-hydroxy-3-(2-naphthoxy)propyl]thio]tetrazol-1-yl]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C25H24N6O3S MolecularWeight: 488.56146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=NN=N3)SCC(COC4=CC5=CC=CC=C5C=C4)O

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=NN=N3)SC[C@@H](COC4=CC5=CC=CC=C5C=C4)O

InChI

InChI=1S/C25H24N6O3S/c1-17-23(24(33)31(29(17)2)20-10-4-3-5-11-20)30-25(26-27-28-30)35-16-21(32)15-34-22-13-12-18-8-6-7-9-19(18)14-22/h3-14,21,32H,15-16H2,1-2H3/t21-/m1/s1