5-bromanyl-2-[(4-nitrophenyl)methoxy]benzenecarbothioamide

Systemtic Name: 5-bromanyl-2-[(4-nitrophenyl)methoxy]benzenecarbothioamide Openeye Name: 5-bromo-2-[(4-nitrophenyl)methoxy]benzenecarbothioamide CAS Name: 5-bromo-2-[(4-nitrophenyl)methoxy]benzenecarbothioamide IUPAC Name: 5-bromo-2-[(4-nitrophenyl)methoxy]benzenecarbothioamide Traditional Name: 5-bromo-2-(4-nitrobenzyl)oxy-thiobenzamide Formula: C14H11BrN2O3S MolecularWeight: 367.21774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC2=C(C=C(C=C2)Br)C(=S)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC2=C(C=C(C=C2)Br)C(=S)N)[N+](=O)[O-]

InChI

InChI=1S/C14H11BrN2O3S/c15-10-3-6-13(12(7-10)14(16)21)20-8-9-1-4-11(5-2-9)17(18)19/h1-7H,8H2,(H2,16,21)