N-(3,4-dimethoxyphenyl)-2-(2-piperidin-1-ylcarbonylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-(2-piperidin-1-ylcarbonylphenyl)sulfanyl-ethanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-[2-(piperidine-1-carbonyl)phenyl]sulfanyl-acetamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[[2-[oxo(1-piperidinyl)methyl]phenyl]thio]acetamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-[2-(piperidine-1-carbonyl)phenyl]sulfanylacetamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[[2-(piperidine-1-carbonyl)phenyl]thio]acetamide Formula: C22H26N2O4S MolecularWeight: 414.51784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSC2=CC=CC=C2C(=O)N3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSC2=CC=CC=C2C(=O)N3CCCCC3)OC

InChI

InChI=1S/C22H26N2O4S/c1-27-18-11-10-16(14-19(18)28-2)23-21(25)15-29-20-9-5-4-8-17(20)22(26)24-12-6-3-7-13-24/h4-5,8-11,14H,3,6-7,12-13,15H2,1-2H3,(H,23,25)