N-(2,5-dimethylphenyl)-3-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: N-(2,5-dimethylphenyl)-3-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: N-(2,5-dimethylphenyl)-3-(4-nitrophenyl)sulfanyl-propanamide CAS Name: N-(2,5-dimethylphenyl)-3-[(4-nitrophenyl)thio]propanamide IUPAC Name: N-(2,5-dimethylphenyl)-3-(4-nitrophenyl)sulfanylpropanamide Traditional Name: N-(2,5-dimethylphenyl)-3-[(4-nitrophenyl)thio]propionamide Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CCSC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CCSC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O3S/c1-12-3-4-13(2)16(11-12)18-17(20)9-10-23-15-7-5-14(6-8-15)19(21)22/h3-8,11H,9-10H2,1-2H3,(H,18,20)