N-[2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-4-methoxy-benzamide

Systemtic Name: N-[2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-4-methoxy-benzamide Openeye Name: N-[2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4-methoxy-benzamide CAS Name: N-[2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-4-methoxybenzamide IUPAC Name: N-[2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4-methoxybenzamide Traditional Name: N-[2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]acetyl]-4-methoxy-benzamide Formula: C16H20N4O3S MolecularWeight: 348.42

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=NN1)SCC(=O)NC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)C1=NC(=NN1)SCC(=O)NC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C16H20N4O3S/c1-16(2,3)14-18-15(20-19-14)24-9-12(21)17-13(22)10-5-7-11(23-4)8-6-10/h5-8H,9H2,1-4H3,(H,17,21,22)(H,18,19,20)