N-(4-chloranyl-3-nitro-phenyl)-2-(2,3,5,6-tetramethylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-2-(2,3,5,6-tetramethylphenyl)sulfanyl-ethanamide Openeye Name: N-(4-chloro-3-nitro-phenyl)-2-(2,3,5,6-tetramethylphenyl)sulfanyl-acetamide CAS Name: N-(4-chloro-3-nitrophenyl)-2-[(2,3,5,6-tetramethylphenyl)thio]acetamide IUPAC Name: N-(4-chloro-3-nitrophenyl)-2-(2,3,5,6-tetramethylphenyl)sulfanylacetamide Traditional Name: N-(4-chloro-3-nitro-phenyl)-2-[(2,3,5,6-tetramethylphenyl)thio]acetamide Formula: C18H19ClN2O3S MolecularWeight: 378.87306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)SCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)SCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C)C

InChI

InChI=1S/C18H19ClN2O3S/c1-10-7-11(2)13(4)18(12(10)3)25-9-17(22)20-14-5-6-15(19)16(8-14)21(23)24/h5-8H,9H2,1-4H3,(H,20,22)