N-(phenylmethyl)-2-[2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanoylamino]ethanamide

Systemtic Name: N-(phenylmethyl)-2-[2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanoylamino]ethanamide Openeye Name: N-benzyl-2-[[2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetyl]amino]acetamide CAS Name: 2-[[1-oxo-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethyl]amino]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[[2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetyl]amino]acetamide Traditional Name: N-benzyl-2-[[2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetyl]amino]acetamide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C16H21N5O2S/c1-2-6-13-19-20-16(24)21(13)11-15(23)18-10-14(22)17-9-12-7-4-3-5-8-12/h3-5,7-8H,2,6,9-11H2,1H3,(H,17,22)(H,18,23)(H,20,24)