N-(2-cyclopentylpyrazol-3-yl)-4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-benzamide

Systemtic Name: N-(2-cyclopentylpyrazol-3-yl)-4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-benzamide Openeye Name: N-(2-cyclopentylpyrazol-3-yl)-4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-benzamide CAS Name: N-(2-cyclopentyl-3-pyrazolyl)-4-[[(2S,6S)-2,6-dimethyl-4-morpholinyl]sulfonyl]benzamide IUPAC Name: N-(2-cyclopentylpyrazol-3-yl)-4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonylbenzamide Traditional Name: N-(2-cyclopentylpyrazol-3-yl)-4-[(2S,6S)-2,6-dimethylmorpholino]sulfonyl-benzamide Formula: C21H28N4O4S MolecularWeight: 432.53642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=NN3C4CCCC4

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=NN3C4CCCC4

InChI

InChI=1S/C21H28N4O4S/c1-15-13-24(14-16(2)29-15)30(27,28)19-9-7-17(8-10-19)21(26)23-20-11-12-22-25(20)18-5-3-4-6-18/h7-12,15-16,18H,3-6,13-14H2,1-2H3,(H,23,26)/t15-,16-/m0/s1