N-[(3-bromanyl-4-methoxy-phenyl)carbamothioyl]-4-nitro-benzamide

Systemtic Name: N-[(3-bromanyl-4-methoxy-phenyl)carbamothioyl]-4-nitro-benzamide Openeye Name: N-[(3-bromo-4-methoxy-phenyl)carbamothioyl]-4-nitro-benzamide CAS Name: N-[(3-bromo-4-methoxyanilino)-sulfanylidenemethyl]-4-nitrobenzamide IUPAC Name: N-[(3-bromo-4-methoxyphenyl)carbamothioyl]-4-nitrobenzamide Traditional Name: N-[(3-bromo-4-methoxy-phenyl)thiocarbamoyl]-4-nitro-benzamide Formula: C15H12BrN3O4S MolecularWeight: 410.24248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C15H12BrN3O4S/c1-23-13-7-4-10(8-12(13)16)17-15(24)18-14(20)9-2-5-11(6-3-9)19(21)22/h2-8H,1H3,(H2,17,18,20,24)