(2S)-N-(3-chloranyl-4-cyano-phenyl)-2-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(3-chloranyl-4-cyano-phenyl)-2-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: (2S)-N-(3-chloro-4-cyano-phenyl)-2-(4-nitrophenyl)sulfanyl-propanamide CAS Name: (2S)-N-(3-chloro-4-cyanophenyl)-2-[(4-nitrophenyl)thio]propanamide IUPAC Name: (2S)-N-(3-chloro-4-cyanophenyl)-2-(4-nitrophenyl)sulfanylpropanamide Traditional Name: (2S)-N-(3-chloro-4-cyano-phenyl)-2-[(4-nitrophenyl)thio]propionamide Formula: C16H12ClN3O3S MolecularWeight: 361.80278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)C#N)Cl)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=C(C=C1)C#N)Cl)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H12ClN3O3S/c1-10(24-14-6-4-13(5-7-14)20(22)23)16(21)19-12-3-2-11(9-18)15(17)8-12/h2-8,10H,1H3,(H,19,21)/t10-/m0/s1