(4R)-2-phenyl-4-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-5-propyl-4H-pyrazol-3-one

Systemtic Name: (4R)-2-phenyl-4-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-5-propyl-4H-pyrazol-3-one Openeye Name: (4R)-2-phenyl-4-(4-phenylthiazol-2-yl)sulfanyl-5-propyl-4H-pyrazol-3-one CAS Name: (4R)-2-phenyl-4-[(4-phenyl-2-thiazolyl)thio]-5-propyl-4H-pyrazol-3-one IUPAC Name: (4R)-2-phenyl-4-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]-5-propyl-4H-pyrazol-3-one Traditional Name: (4R)-2-phenyl-4-[(4-phenylthiazol-2-yl)thio]-5-propyl-2-pyrazolin-3-one Formula: C21H19N3OS2 MolecularWeight: 393.52506

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1SC2=NC(=CS2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCC1=NN(C(=O)[C@@H]1SC2=NC(=CS2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3OS2/c1-2-9-17-19(20(25)24(23-17)16-12-7-4-8-13-16)27-21-22-18(14-26-21)15-10-5-3-6-11-15/h3-8,10-14,19H,2,9H2,1H3/t19-/m1/s1