N-[2-(4-tert-butylphenoxy)ethyl]-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[2-(4-tert-butylphenoxy)ethyl]-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[2-(4-tert-butylphenoxy)ethyl]-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[2-(4-tert-butylphenoxy)ethyl]-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[2-(4-tert-butylphenoxy)ethyl]-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[2-(4-tert-butylphenoxy)ethyl]-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NCCOC2=CC=C(C=C2)C(C)(C)C)C3CC3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NCCOC2=CC=C(C=C2)C(C)(C)C)C3CC3

InChI

InChI=1S/C21H30N4O2S/c1-5-25-19(15-6-7-15)23-24-20(25)28-14-18(26)22-12-13-27-17-10-8-16(9-11-17)21(2,3)4/h8-11,15H,5-7,12-14H2,1-4H3,(H,22,26)