N-(2,6-dimethylphenyl)-4-[3-(4-methoxyphenoxy)propylsulfanyl]butanamide

Systemtic Name: N-(2,6-dimethylphenyl)-4-[3-(4-methoxyphenoxy)propylsulfanyl]butanamide Openeye Name: N-(2,6-dimethylphenyl)-4-[3-(4-methoxyphenoxy)propylsulfanyl]butanamide CAS Name: N-(2,6-dimethylphenyl)-4-[3-(4-methoxyphenoxy)propylthio]butanamide IUPAC Name: N-(2,6-dimethylphenyl)-4-[3-(4-methoxyphenoxy)propylsulfanyl]butanamide Traditional Name: N-(2,6-dimethylphenyl)-4-[3-(4-methoxyphenoxy)propylthio]butyramide Formula: C22H29NO3S MolecularWeight: 387.53556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCCSCCCOC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCCSCCCOC2=CC=C(C=C2)OC

InChI

InChI=1S/C22H29NO3S/c1-17-7-4-8-18(2)22(17)23-21(24)9-5-15-27-16-6-14-26-20-12-10-19(25-3)11-13-20/h4,7-8,10-13H,5-6,9,14-16H2,1-3H3,(H,23,24)