(2R)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-(1-propylimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-(1-propylimidazol-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-(1-propylimidazol-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-[(1-propyl-2-imidazolyl)thio]propanamide IUPAC Name: (2R)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-(1-propylimidazol-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-[(1-propylimidazol-2-yl)thio]propionamide Formula: C20H25N5O2S MolecularWeight: 399.5098

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CN=C1SC(C)C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CCCN1C=CN=C1S[C@H](C)C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C20H25N5O2S/c1-5-12-24-13-11-21-20(24)28-15(3)18(26)22-17-14(2)23(4)25(19(17)27)16-9-7-6-8-10-16/h6-11,13,15H,5,12H2,1-4H3,(H,22,26)/t15-/m1/s1