4-methylsulfanyl-3-piperidin-1-ylcarbonyl-N-(pyridin-4-ylmethyl)benzenesulfonamide

Systemtic Name: 4-methylsulfanyl-3-piperidin-1-ylcarbonyl-N-(pyridin-4-ylmethyl)benzenesulfonamide Openeye Name: 4-methylsulfanyl-3-(piperidine-1-carbonyl)-N-(4-pyridylmethyl)benzenesulfonamide CAS Name: 4-(methylthio)-3-[oxo(1-piperidinyl)methyl]-N-(pyridin-4-ylmethyl)benzenesulfonamide IUPAC Name: 4-methylsulfanyl-3-(piperidine-1-carbonyl)-N-(pyridin-4-ylmethyl)benzenesulfonamide Traditional Name: 4-(methylthio)-3-(piperidine-1-carbonyl)-N-(4-pyridylmethyl)benzenesulfonamide Formula: C19H23N3O3S2 MolecularWeight: 405.53422

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=NC=C2)C(=O)N3CCCCC3

Isomeric SMILES

CSC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=NC=C2)C(=O)N3CCCCC3

InChI

InChI=1S/C19H23N3O3S2/c1-26-18-6-5-16(13-17(18)19(23)22-11-3-2-4-12-22)27(24,25)21-14-15-7-9-20-10-8-15/h5-10,13,21H,2-4,11-12,14H2,1H3