N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-4-phenylsulfanyl-butanamide

Systemtic Name: N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-4-phenylsulfanyl-butanamide Openeye Name: N-[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]-4-phenylsulfanyl-butanamide CAS Name: N-[4-ethoxy-3-(1-piperidinylsulfonyl)phenyl]-4-(phenylthio)butanamide IUPAC Name: N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)-4-phenylsulfanylbutanamide Traditional Name: N-(4-ethoxy-3-piperidinosulfonyl-phenyl)-4-(phenylthio)butyramide Formula: C23H30N2O4S2 MolecularWeight: 462.6253

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CCCSC2=CC=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CCCSC2=CC=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H30N2O4S2/c1-2-29-21-14-13-19(18-22(21)31(27,28)25-15-7-4-8-16-25)24-23(26)12-9-17-30-20-10-5-3-6-11-20/h3,5-6,10-11,13-14,18H,2,4,7-9,12,15-17H2,1H3,(H,24,26)