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

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[1-oxo-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)thio]ethyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[[2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)thio]acetyl]amino]acetamide Formula: C16H20BrN5O2S MolecularWeight: 426.3313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CSC2=NNC(=N2)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CSC2=NNC(=N2)C(C)C

InChI

InChI=1S/C16H20BrN5O2S/c1-9(2)15-20-16(22-21-15)25-8-14(24)18-7-13(23)19-12-5-4-11(17)6-10(12)3/h4-6,9H,7-8H2,1-3H3,(H,18,24)(H,19,23)(H,20,21,22)