(2S)-2-(4-nitrophenyl)sulfanyl-N-[2-oxidanylidene-2-(propylamino)ethyl]propanamide

Systemtic Name: (2S)-2-(4-nitrophenyl)sulfanyl-N-[2-oxidanylidene-2-(propylamino)ethyl]propanamide Openeye Name: (2S)-2-(4-nitrophenyl)sulfanyl-N-[2-oxo-2-(propylamino)ethyl]propanamide CAS Name: (2S)-2-[(4-nitrophenyl)thio]-N-[2-oxo-2-(propylamino)ethyl]propanamide IUPAC Name: (2S)-2-(4-nitrophenyl)sulfanyl-N-[2-oxo-2-(propylamino)ethyl]propanamide Traditional Name: (2S)-N-[2-keto-2-(propylamino)ethyl]-2-[(4-nitrophenyl)thio]propionamide Formula: C14H19N3O4S MolecularWeight: 325.38336

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNC(=O)C(C)SC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)CNC(=O)[C@H](C)SC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O4S/c1-3-8-15-13(18)9-16-14(19)10(2)22-12-6-4-11(5-7-12)17(20)21/h4-7,10H,3,8-9H2,1-2H3,(H,15,18)(H,16,19)/t10-/m0/s1