N-(3-methylbutylcarbamoyl)-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-methylbutylcarbamoyl)-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(isopentylcarbamoyl)-2-[[4-propyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[(3-methylbutylamino)-oxomethyl]-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(3-methylbutylcarbamoyl)-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(isoamylcarbamoyl)-2-[[4-propyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C18H26N6O2S MolecularWeight: 390.50304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC(=O)NC(=O)NCCC(C)C)C2=CC=NC=C2

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)NC(=O)NCCC(C)C)C2=CC=NC=C2

InChI

InChI=1S/C18H26N6O2S/c1-4-11-24-16(14-6-8-19-9-7-14)22-23-18(24)27-12-15(25)21-17(26)20-10-5-13(2)3/h6-9,13H,4-5,10-12H2,1-3H3,(H2,20,21,25,26)