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

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-[[4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-[[4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-bromo-3-methylphenyl)-2-[[4-(3-methoxypropyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-[[4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-[[4-(3-methoxypropyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C15H19BrN4O2S MolecularWeight: 399.30596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CSC2=NN=CN2CCCOC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CSC2=NN=CN2CCCOC)Br

InChI

InChI=1S/C15H19BrN4O2S/c1-11-8-12(4-5-13(11)16)18-14(21)9-23-15-19-17-10-20(15)6-3-7-22-2/h4-5,8,10H,3,6-7,9H2,1-2H3,(H,18,21)