N-[3-(4-chlorophenyl)sulfanyl-5-pyridin-3-yloxy-phenyl]-2-(4-nitroimidazol-1-yl)ethanamide

Systemtic Name: N-[3-(4-chlorophenyl)sulfanyl-5-pyridin-3-yloxy-phenyl]-2-(4-nitroimidazol-1-yl)ethanamide Openeye Name: N-[3-(4-chlorophenyl)sulfanyl-5-(3-pyridyloxy)phenyl]-2-(4-nitroimidazol-1-yl)acetamide CAS Name: N-[3-[(4-chlorophenyl)thio]-5-(3-pyridinyloxy)phenyl]-2-(4-nitro-1-imidazolyl)acetamide IUPAC Name: N-[3-(4-chlorophenyl)sulfanyl-5-pyridin-3-yloxyphenyl]-2-(4-nitroimidazol-1-yl)acetamide Traditional Name: N-[3-[(4-chlorophenyl)thio]-5-(3-pyridyloxy)phenyl]-2-(4-nitroimidazol-1-yl)acetamide Formula: C22H16ClN5O4S MolecularWeight: 481.91154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)OC2=CC(=CC(=C2)NC(=O)CN3C=C(N=C3)[N+](=O)[O-])SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC(=CN=C1)OC2=CC(=CC(=C2)NC(=O)CN3C=C(N=C3)[N+](=O)[O-])SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H16ClN5O4S/c23-15-3-5-19(6-4-15)33-20-9-16(8-18(10-20)32-17-2-1-7-24-11-17)26-22(29)13-27-12-21(25-14-27)28(30)31/h1-12,14H,13H2,(H,26,29)