N-(4-cyanophenyl)-4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonyl-benzamide

Systemtic Name: N-(4-cyanophenyl)-4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonyl-benzamide Openeye Name: N-(4-cyanophenyl)-4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonyl-benzamide CAS Name: N-(4-cyanophenyl)-4-[[(2R,6R)-2,6-dimethyl-4-morpholinyl]sulfonyl]benzamide IUPAC Name: N-(4-cyanophenyl)-4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzamide Traditional Name: N-(4-cyanophenyl)-4-[(2R,6R)-2,6-dimethylmorpholino]sulfonyl-benzamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C[C@@H]1CN(C[C@H](O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H21N3O4S/c1-14-12-23(13-15(2)27-14)28(25,26)19-9-5-17(6-10-19)20(24)22-18-7-3-16(11-21)4-8-18/h3-10,14-15H,12-13H2,1-2H3,(H,22,24)/t14-,15-/m1/s1