3-(3,4-dimethylphenyl)sulfanyl-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)propanamide

Systemtic Name: 3-(3,4-dimethylphenyl)sulfanyl-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)propanamide Openeye Name: 3-(3,4-dimethylphenyl)sulfanyl-N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: 3-[(3,4-dimethylphenyl)thio]-N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: 3-(3,4-dimethylphenyl)sulfanyl-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: 3-[(3,4-dimethylphenyl)thio]-N-(4-methoxy-3-piperidinosulfonyl-phenyl)propionamide Formula: C23H30N2O4S2 MolecularWeight: 462.6253

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC(=O)NC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC(=O)NC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C23H30N2O4S2/c1-17-7-9-20(15-18(17)2)30-14-11-23(26)24-19-8-10-21(29-3)22(16-19)31(27,28)25-12-5-4-6-13-25/h7-10,15-16H,4-6,11-14H2,1-3H3,(H,24,26)