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

Systemtic Name: 3-(4-nitrophenyl)sulfanyl-N-(2,4,6-trimethylphenyl)propanamide Openeye Name: 3-(4-nitrophenyl)sulfanyl-N-(2,4,6-trimethylphenyl)propanamide CAS Name: 3-[(4-nitrophenyl)thio]-N-(2,4,6-trimethylphenyl)propanamide IUPAC Name: 3-(4-nitrophenyl)sulfanyl-N-(2,4,6-trimethylphenyl)propanamide Traditional Name: N-mesityl-3-[(4-nitrophenyl)thio]propionamide Formula: C18H20N2O3S MolecularWeight: 344.428

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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-])C

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O3S/c1-12-10-13(2)18(14(3)11-12)19-17(21)8-9-24-16-6-4-15(5-7-16)20(22)23/h4-7,10-11H,8-9H2,1-3H3,(H,19,21)