2-[2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoyl-methyl-amino]-N-methyl-ethanamide

Systemtic Name: 2-[2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoyl-methyl-amino]-N-methyl-ethanamide Openeye Name: 2-[[2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]-methyl-amino]-N-methyl-acetamide CAS Name: 2-[[2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-methylamino]-N-methylacetamide IUPAC Name: 2-[[2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]-methylamino]-N-methylacetamide Traditional Name: 2-[[2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]thio]acetyl]-methyl-amino]-N-methyl-acetamide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=NN2)SCC(=O)N(C)CC(=O)NC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=NN2)SCC(=O)N(C)CC(=O)NC

InChI

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