N-(2,6-dimethylphenyl)-3-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: N-(2,6-dimethylphenyl)-3-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: N-(2,6-dimethylphenyl)-3-(4-nitrophenyl)sulfanyl-propanamide CAS Name: N-(2,6-dimethylphenyl)-3-[(4-nitrophenyl)thio]propanamide IUPAC Name: N-(2,6-dimethylphenyl)-3-(4-nitrophenyl)sulfanylpropanamide Traditional Name: N-(2,6-dimethylphenyl)-3-[(4-nitrophenyl)thio]propionamide Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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