N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylsulfanyl-propanamide

Systemtic Name: N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylsulfanyl-propanamide Openeye Name: N-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]-2-phenylsulfanyl-propanamide CAS Name: N-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-2-(phenylthio)propanamide IUPAC Name: N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylsulfanylpropanamide Traditional Name: N-[4-(4-methylpiperidino)sulfonylphenyl]-2-(phenylthio)propionamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C(C)SC3=CC=CC=C3

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C(C)SC3=CC=CC=C3

InChI

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