(10bR)-4'-phenyl-2-(4-phenylsulfanylphenyl)spiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,1'-cyclohexane]

Systemtic Name: (10bR)-4'-phenyl-2-(4-phenylsulfanylphenyl)spiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,1'-cyclohexane] Openeye Name: (10bR)-4'-phenyl-2-(4-phenylsulfanylphenyl)spiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,1'-cyclohexane] CAS Name: (10bR)-4'-phenyl-2-[4-(phenylthio)phenyl]spiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,1'-cyclohexane] IUPAC Name: (10bR)-4'-phenyl-2-(4-phenylsulfanylphenyl)spiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,1'-cyclohexane] Traditional Name: (10bR)-4'-phenyl-2-[4-(phenylthio)phenyl]spiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,1'-cyclohexane] Formula: C33H30N2OS MolecularWeight: 502.6691

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCC1C3=CC=CC=C3)N4C(C=C(N4)C5=CC=C(C=C5)SC6=CC=CC=C6)C7=CC=CC=C7O2

Isomeric SMILES

C1CC2(CCC1C3=CC=CC=C3)N4[C@H](C=C(N4)C5=CC=C(C=C5)SC6=CC=CC=C6)C7=CC=CC=C7O2

InChI

InChI=1S/C33H30N2OS/c1-3-9-24(10-4-1)25-19-21-33(22-20-25)35-31(29-13-7-8-14-32(29)36-33)23-30(34-35)26-15-17-28(18-16-26)37-27-11-5-2-6-12-27/h1-18,23,25,31,34H,19-22H2/t25?,31-,33?/m1/s1