2-bromanyl-N-[(5-chloranyl-2-methyl-4-nitro-phenyl)carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[(5-chloranyl-2-methyl-4-nitro-phenyl)carbamothioyl]benzamide Openeye Name: 2-bromo-N-[(5-chloro-2-methyl-4-nitro-phenyl)carbamothioyl]benzamide CAS Name: 2-bromo-N-[(5-chloro-2-methyl-4-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[(5-chloro-2-methyl-4-nitrophenyl)carbamothioyl]benzamide Traditional Name: 2-bromo-N-[(5-chloro-2-methyl-4-nitro-phenyl)thiocarbamoyl]benzamide Formula: C15H11BrClN3O3S MolecularWeight: 428.68814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=S)NC(=O)C2=CC=CC=C2Br)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1NC(=S)NC(=O)C2=CC=CC=C2Br)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H11BrClN3O3S/c1-8-6-13(20(22)23)11(17)7-12(8)18-15(24)19-14(21)9-4-2-3-5-10(9)16/h2-7H,1H3,(H2,18,19,21,24)