N-[4-(4-morpholin-4-ylsulfonylphenyl)-1,3-thiazol-2-yl]-2-nitro-benzamide

Systemtic Name: N-[4-(4-morpholin-4-ylsulfonylphenyl)-1,3-thiazol-2-yl]-2-nitro-benzamide Openeye Name: N-[4-(4-morpholinosulfonylphenyl)thiazol-2-yl]-2-nitro-benzamide CAS Name: N-[4-[4-(4-morpholinylsulfonyl)phenyl]-2-thiazolyl]-2-nitrobenzamide IUPAC Name: N-[4-(4-morpholin-4-ylsulfonylphenyl)-1,3-thiazol-2-yl]-2-nitrobenzamide Traditional Name: N-[4-(4-morpholinosulfonylphenyl)thiazol-2-yl]-2-nitro-benzamide Formula: C20H18N4O6S2 MolecularWeight: 474.51012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O6S2/c25-19(16-3-1-2-4-18(16)24(26)27)22-20-21-17(13-31-20)14-5-7-15(8-6-14)32(28,29)23-9-11-30-12-10-23/h1-8,13H,9-12H2,(H,21,22,25)