4-tert-butyl-N-[2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]benzamide Openeye Name: 4-tert-butyl-N-[2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]benzamide CAS Name: 4-tert-butyl-N-[1-oxo-2-[(4-pentyl-1,2,4-triazol-3-yl)thio]ethyl]benzamide IUPAC Name: 4-tert-butyl-N-[2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]benzamide Traditional Name: N-[2-[(4-amyl-1,2,4-triazol-3-yl)thio]acetyl]-4-tert-butyl-benzamide Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=NN=C1SCC(=O)NC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCCCCN1C=NN=C1SCC(=O)NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C20H28N4O2S/c1-5-6-7-12-24-14-21-23-19(24)27-13-17(25)22-18(26)15-8-10-16(11-9-15)20(2,3)4/h8-11,14H,5-7,12-13H2,1-4H3,(H,22,25,26)