N-(4-bromanyl-2-methyl-phenyl)-2-[2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[1-oxo-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]ethyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[[2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]acetyl]amino]acetamide Formula: C16H20BrN5O3S MolecularWeight: 442.3307

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC(=O)NCC(=O)NC2=C(C=C(C=C2)Br)C

Isomeric SMILES

CCCN1C(=O)NN=C1SCC(=O)NCC(=O)NC2=C(C=C(C=C2)Br)C

InChI

InChI=1S/C16H20BrN5O3S/c1-3-6-22-15(25)20-21-16(22)26-9-14(24)18-8-13(23)19-12-5-4-11(17)7-10(12)2/h4-5,7H,3,6,8-9H2,1-2H3,(H,18,24)(H,19,23)(H,20,25)