4-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-(2-phenylhydrazinyl)butan-2-yl]iminopentanoic acid

Systemtic Name: 4-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-(2-phenylhydrazinyl)butan-2-yl]iminopentanoic acid Openeye Name: 4-[(1S)-1-(anilinocarbamoyl)-3-methylsulfanyl-propyl]iminopentanoic acid CAS Name: 4-[(2S)-4-(methylthio)-1-oxo-1-(phenylhydrazo)butan-2-yl]iminopentanoic acid IUPAC Name: 4-[(2S)-4-methylsulfanyl-1-oxo-1-(2-phenylhydrazinyl)butan-2-yl]iminopentanoic acid Traditional Name: 4-[(1S)-1-(anilinocarbamoyl)-3-(methylthio)propyl]iminovaleric acid Formula: C16H23N3O3S MolecularWeight: 337.43712

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC(CCSC)C(=O)NNC1=CC=CC=C1)CCC(=O)O

Isomeric SMILES

CC(=N[C@@H](CCSC)C(=O)NNC1=CC=CC=C1)CCC(=O)O

InChI

InChI=1S/C16H23N3O3S/c1-12(8-9-15(20)21)17-14(10-11-23-2)16(22)19-18-13-6-4-3-5-7-13/h3-7,14,18H,8-11H2,1-2H3,(H,19,22)(H,20,21)/t14-/m0/s1