1',3',4'-triphenylspiro[2H-thiochromene-3,5'-4H-pyrazole]-4-one

Systemtic Name: 1',3',4'-triphenylspiro[2H-thiochromene-3,5'-4H-pyrazole]-4-one Openeye Name: 1,3,4-triphenylspiro[4H-pyrazole-5,3'-thiochromane]-4'-one CAS Name: 1',3',4'-triphenyl-4-spiro[2H-1-benzothiopyran-3,5'-4H-pyrazole]one IUPAC Name: 1',3',4'-triphenylspiro[2H-thiochromene-3,5'-4H-pyrazole]-4-one Traditional Name: 1,3,4-triphenylspiro[2-pyrazoline-5,3'-thiochroman]-4'-one Formula: C29H22N2OS MolecularWeight: 446.56278

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Descriptors Computed from Structure

Canonical SMILES:

C1C2(C(C(=NN2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C(=O)C6=CC=CC=C6S1

Isomeric SMILES

C1C2(C(C(=NN2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C(=O)C6=CC=CC=C6S1

InChI

InChI=1S/C29H22N2OS/c32-28-24-18-10-11-19-25(24)33-20-29(28)26(21-12-4-1-5-13-21)27(22-14-6-2-7-15-22)30-31(29)23-16-8-3-9-17-23/h1-19,26H,20H2