N-[4-(2-cyanopropan-2-yl)phenyl]-2-methoxy-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[4-(2-cyanopropan-2-yl)phenyl]-2-methoxy-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[4-(1-cyano-1-methyl-ethyl)phenyl]-2-methoxy-5-morpholinosulfonyl-benzamide CAS Name: N-[4-(2-cyanopropan-2-yl)phenyl]-2-methoxy-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[4-(2-cyanopropan-2-yl)phenyl]-2-methoxy-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[4-(1-cyano-1-methyl-ethyl)phenyl]-2-methoxy-5-morpholinosulfonyl-benzamide Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)OC

Isomeric SMILES

CC(C)(C#N)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)OC

InChI

InChI=1S/C22H25N3O5S/c1-22(2,15-23)16-4-6-17(7-5-16)24-21(26)19-14-18(8-9-20(19)29-3)31(27,28)25-10-12-30-13-11-25/h4-9,14H,10-13H2,1-3H3,(H,24,26)