2-[2-[(2,3-dimethoxyphenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[2-[(2,3-dimethoxyphenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]sulfanyl-N-(4-methylphenyl)ethanamide Openeye Name: 2-[2-[(2,3-dimethoxyphenyl)methyl-methyl-amino]-2-oxo-ethyl]sulfanyl-N-(p-tolyl)acetamide CAS Name: 2-[[2-[(2,3-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]thio]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[2-[(2,3-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]sulfanyl-N-(4-methylphenyl)acetamide Traditional Name: 2-[[2-keto-2-[methyl(o-veratryl)amino]ethyl]thio]-N-(p-tolyl)acetamide Formula: C21H26N2O4S MolecularWeight: 402.50714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCC(=O)N(C)CC2=C(C(=CC=C2)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSCC(=O)N(C)CC2=C(C(=CC=C2)OC)OC

InChI

InChI=1S/C21H26N2O4S/c1-15-8-10-17(11-9-15)22-19(24)13-28-14-20(25)23(2)12-16-6-5-7-18(26-3)21(16)27-4/h5-11H,12-14H2,1-4H3,(H,22,24)