N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-[(4-ethyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-[(4-ethyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-[(4-ethyl-5-morpholino-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(5-tert-butyl-2-phenyl-3-pyrazolyl)-2-[[4-ethyl-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(5-tert-butyl-2-phenylpyrazol-3-yl)-2-[(4-ethyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-[(4-ethyl-5-morpholino-1,2,4-triazol-3-yl)thio]acetamide Formula: C23H31N7O2S MolecularWeight: 469.60294

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C(C)(C)C)N4CCOCC4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C(C)(C)C)N4CCOCC4

InChI

InChI=1S/C23H31N7O2S/c1-5-29-21(28-11-13-32-14-12-28)25-26-22(29)33-16-20(31)24-19-15-18(23(2,3)4)27-30(19)17-9-7-6-8-10-17/h6-10,15H,5,11-14,16H2,1-4H3,(H,24,31)