N-[5-(4-tert-butylphenyl)-2-phenyl-pyrazol-3-yl]-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[5-(4-tert-butylphenyl)-2-phenyl-pyrazol-3-yl]-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[5-(4-tert-butylphenyl)-2-phenyl-pyrazol-3-yl]-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[5-(4-tert-butylphenyl)-2-phenyl-3-pyrazolyl]-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[5-(4-tert-butylphenyl)-2-phenylpyrazol-3-yl]-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[5-(4-tert-butylphenyl)-2-phenyl-pyrazol-3-yl]-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C26H28N6OS MolecularWeight: 472.60512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)CSC3=NN=CN3C4CC4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)CSC3=NN=CN3C4CC4)C5=CC=CC=C5

InChI

InChI=1S/C26H28N6OS/c1-26(2,3)19-11-9-18(10-12-19)22-15-23(32(30-22)21-7-5-4-6-8-21)28-24(33)16-34-25-29-27-17-31(25)20-13-14-20/h4-12,15,17,20H,13-14,16H2,1-3H3,(H,28,33)