2-chloranyl-N-(4-methylsulfanylphenyl)-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-(4-methylsulfanylphenyl)-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-(4-methylsulfanylphenyl)-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-[4-(methylthio)phenyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-(4-methylsulfanylphenyl)-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[4-(methylthio)phenyl]-5-piperidinosulfonyl-benzamide Formula: C19H21ClN2O3S2 MolecularWeight: 424.96464

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

InChI

InChI=1S/C19H21ClN2O3S2/c1-26-15-7-5-14(6-8-15)21-19(23)17-13-16(9-10-18(17)20)27(24,25)22-11-3-2-4-12-22/h5-10,13H,2-4,11-12H2,1H3,(H,21,23)