2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)-N-(2-prop-2-enylsulfanylphenyl)ethanamide

Systemtic Name: 2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)-N-(2-prop-2-enylsulfanylphenyl)ethanamide Openeye Name: N-(2-allylsulfanylphenyl)-2-(4-morpholinosulfonyl-2-nitro-phenoxy)acetamide CAS Name: 2-[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]-N-[2-(prop-2-enylthio)phenyl]acetamide IUPAC Name: 2-(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)-N-(2-prop-2-enylsulfanylphenyl)acetamide Traditional Name: N-[2-(allylthio)phenyl]-2-(4-morpholinosulfonyl-2-nitro-phenoxy)acetamide Formula: C21H23N3O7S2 MolecularWeight: 493.55322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=CC=CC=C1NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

C=CCSC1=CC=CC=C1NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O7S2/c1-2-13-32-20-6-4-3-5-17(20)22-21(25)15-31-19-8-7-16(14-18(19)24(26)27)33(28,29)23-9-11-30-12-10-23/h2-8,14H,1,9-13,15H2,(H,22,25)