5-bromanyl-N-(2-chloranyl-4-nitro-phenyl)-2-prop-2-enylsulfanyl-benzamide

Systemtic Name: 5-bromanyl-N-(2-chloranyl-4-nitro-phenyl)-2-prop-2-enylsulfanyl-benzamide Openeye Name: 2-allylsulfanyl-5-bromo-N-(2-chloro-4-nitro-phenyl)benzamide CAS Name: 5-bromo-N-(2-chloro-4-nitrophenyl)-2-(prop-2-enylthio)benzamide IUPAC Name: 5-bromo-N-(2-chloro-4-nitrophenyl)-2-prop-2-enylsulfanylbenzamide Traditional Name: 2-(allylthio)-5-bromo-N-(2-chloro-4-nitro-phenyl)benzamide Formula: C16H12BrClN2O3S MolecularWeight: 427.70008

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=C(C=C(C=C1)Br)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C=CCSC1=C(C=C(C=C1)Br)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H12BrClN2O3S/c1-2-7-24-15-6-3-10(17)8-12(15)16(21)19-14-5-4-11(20(22)23)9-13(14)18/h2-6,8-9H,1,7H2,(H,19,21)