(2S)-N-(2,4-dimethylphenyl)-2-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(2,4-dimethylphenyl)-2-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: (2S)-N-(2,4-dimethylphenyl)-2-(4-nitrophenyl)sulfanyl-propanamide CAS Name: (2S)-N-(2,4-dimethylphenyl)-2-[(4-nitrophenyl)thio]propanamide IUPAC Name: (2S)-N-(2,4-dimethylphenyl)-2-(4-nitrophenyl)sulfanylpropanamide Traditional Name: (2S)-N-(2,4-dimethylphenyl)-2-[(4-nitrophenyl)thio]propionamide Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)[C@H](C)SC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C17H18N2O3S/c1-11-4-9-16(12(2)10-11)18-17(20)13(3)23-15-7-5-14(6-8-15)19(21)22/h4-10,13H,1-3H3,(H,18,20)/t13-/m0/s1