N-(4-bromanyl-2-methyl-phenyl)-2-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-(4-nitrophenyl)sulfanyl-propanamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[(4-nitrophenyl)thio]propanamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-(4-nitrophenyl)sulfanylpropanamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[(4-nitrophenyl)thio]propionamide Formula: C16H15BrN2O3S MolecularWeight: 395.2709

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrN2O3S/c1-10-9-12(17)3-8-15(10)18-16(20)11(2)23-14-6-4-13(5-7-14)19(21)22/h3-9,11H,1-2H3,(H,18,20)