4-[2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: 4-[[2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide CAS Name: 4-[[1-oxo-2-[(4-pentyl-1,2,4-triazol-3-yl)thio]ethyl]amino]benzamide IUPAC Name: 4-[[2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: 4-[[2-[(4-amyl-1,2,4-triazol-3-yl)thio]acetyl]amino]benzamide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)N

Isomeric SMILES

CCCCCN1C=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C16H21N5O2S/c1-2-3-4-9-21-11-18-20-16(21)24-10-14(22)19-13-7-5-12(6-8-13)15(17)23/h5-8,11H,2-4,9-10H2,1H3,(H2,17,23)(H,19,22)