2-ethylsulfanyl-N-(2-piperidin-1-yl-5-piperidin-1-ylsulfonyl-phenyl)benzamide

Systemtic Name: 2-ethylsulfanyl-N-(2-piperidin-1-yl-5-piperidin-1-ylsulfonyl-phenyl)benzamide Openeye Name: 2-ethylsulfanyl-N-[2-(1-piperidyl)-5-(1-piperidylsulfonyl)phenyl]benzamide CAS Name: 2-(ethylthio)-N-[2-(1-piperidinyl)-5-(1-piperidinylsulfonyl)phenyl]benzamide IUPAC Name: 2-ethylsulfanyl-N-(2-piperidin-1-yl-5-piperidin-1-ylsulfonylphenyl)benzamide Traditional Name: 2-(ethylthio)-N-(2-piperidino-5-piperidinosulfonyl-phenyl)benzamide Formula: C25H33N3O3S2 MolecularWeight: 487.67782

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCCCC4

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCCCC4

InChI

InChI=1S/C25H33N3O3S2/c1-2-32-24-12-6-5-11-21(24)25(29)26-22-19-20(33(30,31)28-17-9-4-10-18-28)13-14-23(22)27-15-7-3-8-16-27/h5-6,11-14,19H,2-4,7-10,15-18H2,1H3,(H,26,29)