N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-(1-methylimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-(1-methylimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-(1-methylimidazol-2-yl)sulfanyl-propanamide CAS Name: N-(5-tert-butyl-2-phenyl-3-pyrazolyl)-2-[(1-methyl-2-imidazolyl)thio]propanamide IUPAC Name: N-(5-tert-butyl-2-phenylpyrazol-3-yl)-2-(1-methylimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-[(1-methylimidazol-2-yl)thio]propionamide Formula: C20H25N5OS MolecularWeight: 383.5104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=NN1C2=CC=CC=C2)C(C)(C)C)SC3=NC=CN3C

Isomeric SMILES

CC(C(=O)NC1=CC(=NN1C2=CC=CC=C2)C(C)(C)C)SC3=NC=CN3C

InChI

InChI=1S/C20H25N5OS/c1-14(27-19-21-11-12-24(19)5)18(26)22-17-13-16(20(2,3)4)23-25(17)15-9-7-6-8-10-15/h6-14H,1-5H3,(H,22,26)