N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-2-methylsulfanyl-benzamide

Systemtic Name: N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-2-methylsulfanyl-benzamide Openeye Name: N-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]-2-methylsulfanyl-benzamide CAS Name: N-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]-2-(methylthio)benzamide IUPAC Name: N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-2-methylsulfanylbenzamide Traditional Name: N-[4-(2,6-dimethylpiperidino)sulfonylphenyl]-2-(methylthio)benzamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SC)C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SC)C

InChI

InChI=1S/C21H26N2O3S2/c1-15-7-6-8-16(2)23(15)28(25,26)18-13-11-17(12-14-18)22-21(24)19-9-4-5-10-20(19)27-3/h4-5,9-16H,6-8H2,1-3H3,(H,22,24)