2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(3,4,5-trimethoxyphenyl)propanamide

Systemtic Name: 2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(3,4,5-trimethoxyphenyl)propanamide Openeye Name: 2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-N-(3,4,5-trimethoxyphenyl)propanamide CAS Name: 2-[[2-(4-methylanilino)-2-oxoethyl]thio]-N-(3,4,5-trimethoxyphenyl)propanamide IUPAC Name: 2-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-N-(3,4,5-trimethoxyphenyl)propanamide Traditional Name: 2-[[2-keto-2-(p-toluidino)ethyl]thio]-N-(3,4,5-trimethoxyphenyl)propionamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC(C)C(=O)NC2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC(C)C(=O)NC2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C21H26N2O5S/c1-13-6-8-15(9-7-13)22-19(24)12-29-14(2)21(25)23-16-10-17(26-3)20(28-5)18(11-16)27-4/h6-11,14H,12H2,1-5H3,(H,22,24)(H,23,25)