2-(4-nitroimidazol-1-yl)-N-(2-prop-2-enylsulfanylphenyl)ethanamide

Systemtic Name: 2-(4-nitroimidazol-1-yl)-N-(2-prop-2-enylsulfanylphenyl)ethanamide Openeye Name: N-(2-allylsulfanylphenyl)-2-(4-nitroimidazol-1-yl)acetamide CAS Name: 2-(4-nitro-1-imidazolyl)-N-[2-(prop-2-enylthio)phenyl]acetamide IUPAC Name: 2-(4-nitroimidazol-1-yl)-N-(2-prop-2-enylsulfanylphenyl)acetamide Traditional Name: N-[2-(allylthio)phenyl]-2-(4-nitroimidazol-1-yl)acetamide Formula: C14H14N4O3S MolecularWeight: 318.35096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=CC=CC=C1NC(=O)CN2C=C(N=C2)[N+](=O)[O-]

Isomeric SMILES

C=CCSC1=CC=CC=C1NC(=O)CN2C=C(N=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H14N4O3S/c1-2-7-22-12-6-4-3-5-11(12)16-14(19)9-17-8-13(15-10-17)18(20)21/h2-6,8,10H,1,7,9H2,(H,16,19)