4-[2,5-dimethyl-3-[2-(phenylmethyl)-1,3-thiazol-4-yl]pyrrol-1-yl]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[2,5-dimethyl-3-[2-(phenylmethyl)-1,3-thiazol-4-yl]pyrrol-1-yl]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[3-(2-benzylthiazol-4-yl)-2,5-dimethyl-pyrrol-1-yl]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[2,5-dimethyl-3-[2-(phenylmethyl)-4-thiazolyl]-1-pyrrolyl]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[3-(2-benzyl-1,3-thiazol-4-yl)-2,5-dimethylpyrrol-1-yl]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[3-(2-benzylthiazol-4-yl)-2,5-dimethyl-pyrrol-1-yl]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C27H26N4OS MolecularWeight: 454.58654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C)C4=CSC(=N4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(N1C2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C)C4=CSC(=N4)CC5=CC=CC=C5

InChI

InChI=1S/C27H26N4OS/c1-18-15-23(24-17-33-25(28-24)16-21-11-7-5-8-12-21)19(2)30(18)26-20(3)29(4)31(27(26)32)22-13-9-6-10-14-22/h5-15,17H,16H2,1-4H3