N-(3-methyl-1,2-thiazol-5-yl)-1-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperidine-4-carboxamide

Systemtic Name: N-(3-methyl-1,2-thiazol-5-yl)-1-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperidine-4-carboxamide Openeye Name: N-(3-methylisothiazol-5-yl)-1-(4-morpholinosulfonyl-2-nitro-phenyl)piperidine-4-carboxamide CAS Name: N-(3-methyl-5-isothiazolyl)-1-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-4-piperidinecarboxamide IUPAC Name: N-(3-methyl-1,2-thiazol-5-yl)-1-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-(3-methylisothiazol-5-yl)-1-(4-morpholinosulfonyl-2-nitro-phenyl)isonipecotamide Formula: C20H25N5O6S2 MolecularWeight: 495.5724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1)NC(=O)C2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=NSC(=C1)NC(=O)C2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C20H25N5O6S2/c1-14-12-19(32-22-14)21-20(26)15-4-6-23(7-5-15)17-3-2-16(13-18(17)25(27)28)33(29,30)24-8-10-31-11-9-24/h2-3,12-13,15H,4-11H2,1H3,(H,21,26)