N-(2,5-dimethylphenyl)-4-[(2S)-2-methylpiperidin-1-yl]sulfonyl-benzamide

Systemtic Name: N-(2,5-dimethylphenyl)-4-[(2S)-2-methylpiperidin-1-yl]sulfonyl-benzamide Openeye Name: N-(2,5-dimethylphenyl)-4-[[(2S)-2-methyl-1-piperidyl]sulfonyl]benzamide CAS Name: N-(2,5-dimethylphenyl)-4-[[(2S)-2-methyl-1-piperidinyl]sulfonyl]benzamide IUPAC Name: N-(2,5-dimethylphenyl)-4-[(2S)-2-methylpiperidin-1-yl]sulfonylbenzamide Traditional Name: N-(2,5-dimethylphenyl)-4-[(2S)-2-methylpiperidino]sulfonyl-benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C)C

Isomeric SMILES

C[C@H]1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C21H26N2O3S/c1-15-7-8-16(2)20(14-15)22-21(24)18-9-11-19(12-10-18)27(25,26)23-13-5-4-6-17(23)3/h7-12,14,17H,4-6,13H2,1-3H3,(H,22,24)/t17-/m0/s1