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

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[[4-(3-methoxypropyl)-5-oxidanylidene-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[[5-keto-4-(3-methoxypropyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C15H19BrN4O3S MolecularWeight: 415.30536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CSC2=NNC(=O)N2CCCOC

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CSC2=NNC(=O)N2CCCOC

InChI

InChI=1S/C15H19BrN4O3S/c1-10-8-11(16)4-5-12(10)17-13(21)9-24-15-19-18-14(22)20(15)6-3-7-23-2/h4-5,8H,3,6-7,9H2,1-2H3,(H,17,21)(H,18,22)