N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-3-(methylsulfanylmethyl)benzamide

Systemtic Name: N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-3-(methylsulfanylmethyl)benzamide Openeye Name: N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-3-(methylsulfanylmethyl)benzamide CAS Name: N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-3-[(methylthio)methyl]benzamide IUPAC Name: N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-3-(methylsulfanylmethyl)benzamide Traditional Name: N-(4-methyl-3-piperidinosulfonyl-phenyl)-3-[(methylthio)methyl]benzamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)CSC)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)CSC)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H26N2O3S2/c1-16-9-10-19(14-20(16)28(25,26)23-11-4-3-5-12-23)22-21(24)18-8-6-7-17(13-18)15-27-2/h6-10,13-14H,3-5,11-12,15H2,1-2H3,(H,22,24)