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

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]ethanoylamino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]acetyl]amino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[2-[(3,5-dimethyl-1H-pyrazol-4-yl)thio]-1-oxoethyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[[2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]acetyl]amino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-[(3,5-dimethyl-1H-pyrazol-4-yl)thio]acetyl]amino]acetamide Formula: C16H19BrN4O2S MolecularWeight: 411.31666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CSC2=C(NN=C2C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CSC2=C(NN=C2C)C

InChI

InChI=1S/C16H19BrN4O2S/c1-9-6-12(17)4-5-13(9)19-14(22)7-18-15(23)8-24-16-10(2)20-21-11(16)3/h4-6H,7-8H2,1-3H3,(H,18,23)(H,19,22)(H,20,21)