N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-(2-pyridin-4-ylcarbonylhydrazinyl)butan-2-yl]ethanamide

Systemtic Name: N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-(2-pyridin-4-ylcarbonylhydrazinyl)butan-2-yl]ethanamide Openeye Name: N-[(1S)-3-methylsulfanyl-1-[(pyridine-4-carbonylamino)carbamoyl]propyl]acetamide CAS Name: N-[(2S)-4-(methylthio)-1-oxo-1-[[oxo(pyridin-4-yl)methyl]hydrazo]butan-2-yl]acetamide IUPAC Name: N-[(2S)-4-methylsulfanyl-1-oxo-1-[2-(pyridine-4-carbonyl)hydrazinyl]butan-2-yl]acetamide Traditional Name: N-[(1S)-1-(isonicotinamidocarbamoyl)-3-(methylthio)propyl]acetamide Formula: C13H18N4O3S MolecularWeight: 310.37202

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCSC)C(=O)NNC(=O)C1=CC=NC=C1

Isomeric SMILES

CC(=O)N[C@@H](CCSC)C(=O)NNC(=O)C1=CC=NC=C1

InChI

InChI=1S/C13H18N4O3S/c1-9(18)15-11(5-8-21-2)13(20)17-16-12(19)10-3-6-14-7-4-10/h3-4,6-7,11H,5,8H2,1-2H3,(H,15,18)(H,16,19)(H,17,20)/t11-/m0/s1