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

Systemtic Name: N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-2-phenylsulfanyl-propanamide Openeye Name: N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]-2-phenylsulfanyl-propanamide CAS Name: N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-2-(phenylthio)propanamide IUPAC Name: N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)-2-phenylsulfanylpropanamide Traditional Name: N-(2-methyl-5-piperidinosulfonyl-phenyl)-2-(phenylthio)propionamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C(C)SC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C(C)SC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O3S2/c1-16-11-12-19(28(25,26)23-13-7-4-8-14-23)15-20(16)22-21(24)17(2)27-18-9-5-3-6-10-18/h3,5-6,9-12,15,17H,4,7-8,13-14H2,1-2H3,(H,22,24)