N-[(2S)-1-[2-(2,5-dimethylfuran-3-yl)carbonylhydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[(2S)-1-[2-(2,5-dimethylfuran-3-yl)carbonylhydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide Openeye Name: N-[(1S)-1-[[(2,5-dimethylfuran-3-carbonyl)amino]carbamoyl]-3-methylsulfanyl-propyl]-2-phenoxy-acetamide CAS Name: N-[(2S)-1-[[(2,5-dimethyl-3-furanyl)-oxomethyl]hydrazo]-4-(methylthio)-1-oxobutan-2-yl]-2-phenoxyacetamide IUPAC Name: N-[(2S)-1-[2-(2,5-dimethylfuran-3-carbonyl)hydrazinyl]-4-methylsulfanyl-1-oxobutan-2-yl]-2-phenoxyacetamide Traditional Name: N-[(1S)-1-[[(2,5-dimethyl-3-furoyl)amino]carbamoyl]-3-(methylthio)propyl]-2-phenoxy-acetamide Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)NNC(=O)C(CCSC)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)NNC(=O)[C@H](CCSC)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C20H25N3O5S/c1-13-11-16(14(2)28-13)19(25)22-23-20(26)17(9-10-29-3)21-18(24)12-27-15-7-5-4-6-8-15/h4-8,11,17H,9-10,12H2,1-3H3,(H,21,24)(H,22,25)(H,23,26)/t17-/m0/s1