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

Systemtic Name: N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide Openeye Name: N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-propanamide CAS Name: N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-2-[[2-(4-methylanilino)-2-oxoethyl]thio]propanamide IUPAC Name: N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanamide Traditional Name: 2-[[2-keto-2-(p-toluidino)ethyl]thio]-N-methyl-N-o-veratryl-propionamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O4S/c1-15-9-11-18(12-10-15)23-20(25)14-29-16(2)22(26)24(3)13-17-7-6-8-19(27-4)21(17)28-5/h6-12,16H,13-14H2,1-5H3,(H,23,25)