N,2-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N,2-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N,2-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-5-(1-piperidylsulfonyl)benzamide CAS Name: N,2-dimethyl-N-[[4-(methylthio)phenyl]methyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N,2-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N,2-dimethyl-N-[4-(methylthio)benzyl]-5-piperidinosulfonyl-benzamide Formula: C22H28N2O3S2 MolecularWeight: 432.59932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)N(C)CC3=CC=C(C=C3)SC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)N(C)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C22H28N2O3S2/c1-17-7-12-20(29(26,27)24-13-5-4-6-14-24)15-21(17)22(25)23(2)16-18-8-10-19(28-3)11-9-18/h7-12,15H,4-6,13-14,16H2,1-3H3