2-[3-[(4-tert-butylphenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-yl]ethanamide

Systemtic Name: 2-[3-[(4-tert-butylphenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-yl]ethanamide Openeye Name: 2-[3-[(4-tert-butylphenyl)methylsulfanyl]-5-(2-thienyl)-1,2,4-triazol-4-yl]acetamide CAS Name: 2-[3-[(4-tert-butylphenyl)methylthio]-5-thiophen-2-yl-1,2,4-triazol-4-yl]acetamide IUPAC Name: 2-[3-[(4-tert-butylphenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-yl]acetamide Traditional Name: 2-[3-[(4-tert-butylbenzyl)thio]-5-(2-thienyl)-1,2,4-triazol-4-yl]acetamide Formula: C19H22N4OS2 MolecularWeight: 386.53418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(N2CC(=O)N)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(N2CC(=O)N)C3=CC=CS3

InChI

InChI=1S/C19H22N4OS2/c1-19(2,3)14-8-6-13(7-9-14)12-26-18-22-21-17(15-5-4-10-25-15)23(18)11-16(20)24/h4-10H,11-12H2,1-3H3,(H2,20,24)