N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-3-phenylsulfanyl-propanamide

Systemtic Name: N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-3-phenylsulfanyl-propanamide Openeye Name: N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]-3-phenylsulfanyl-propanamide CAS Name: N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]-3-(phenylthio)propanamide IUPAC Name: N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-3-phenylsulfanylpropanamide Traditional Name: N-(2-methoxy-5-piperidinosulfonyl-phenyl)-3-(phenylthio)propionamide Formula: C21H26N2O4S2 MolecularWeight: 434.57214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CCSC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CCSC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O4S2/c1-27-20-11-10-18(29(25,26)23-13-6-3-7-14-23)16-19(20)22-21(24)12-15-28-17-8-4-2-5-9-17/h2,4-5,8-11,16H,3,6-7,12-15H2,1H3,(H,22,24)