N-[1-[2-[2-(3,5-dimethylpyrazol-1-yl)ethanoyl]hydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[1-[2-[2-(3,5-dimethylpyrazol-1-yl)ethanoyl]hydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide Openeye Name: N-[1-[[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]carbamoyl]-3-methylsulfanyl-propyl]-2-phenoxy-acetamide CAS Name: N-[1-[[2-(3,5-dimethyl-1-pyrazolyl)-1-oxoethyl]hydrazo]-4-(methylthio)-1-oxobutan-2-yl]-2-phenoxyacetamide IUPAC Name: N-[1-[2-[2-(3,5-dimethylpyrazol-1-yl)acetyl]hydrazinyl]-4-methylsulfanyl-1-oxobutan-2-yl]-2-phenoxyacetamide Traditional Name: N-[1-[[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]carbamoyl]-3-(methylthio)propyl]-2-phenoxy-acetamide Formula: C20H27N5O4S MolecularWeight: 433.52448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(=O)NNC(=O)C(CCSC)NC(=O)COC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=NN1CC(=O)NNC(=O)C(CCSC)NC(=O)COC2=CC=CC=C2)C

InChI

InChI=1S/C20H27N5O4S/c1-14-11-15(2)25(24-14)12-18(26)22-23-20(28)17(9-10-30-3)21-19(27)13-29-16-7-5-4-6-8-16/h4-8,11,17H,9-10,12-13H2,1-3H3,(H,21,27)(H,22,26)(H,23,28)