4-butyl-1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-butyl-1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-butyl-1-[4-(4-chlorophenyl)thiazol-2-yl]-2-phenyl-pyrazolidine-3,5-dione CAS Name: 4-butyl-1-[4-(4-chlorophenyl)-2-thiazolyl]-2-phenylpyrazolidine-3,5-dione IUPAC Name: 4-butyl-1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-phenylpyrazolidine-3,5-dione Traditional Name: 4-butyl-1-[4-(4-chlorophenyl)thiazol-2-yl]-2-phenyl-pyrazolidine-3,5-quinone Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)N(N(C1=O)C2=NC(=CS2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCCCC1C(=O)N(N(C1=O)C2=NC(=CS2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H20ClN3O2S/c1-2-3-9-18-20(27)25(17-7-5-4-6-8-17)26(21(18)28)22-24-19(14-29-22)15-10-12-16(23)13-11-15/h4-8,10-14,18H,2-3,9H2,1H3