N-[2-(2-methoxy-5-methyl-phenyl)ethyl]-2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-[2-(2-methoxy-5-methyl-phenyl)ethyl]-2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-[2-(2-methoxy-5-methyl-phenyl)ethyl]-2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-[2-(2-methoxy-5-methylphenyl)ethyl]-2-[[2-(3-methylanilino)-2-oxoethyl]thio]acetamide IUPAC Name: N-[2-(2-methoxy-5-methylphenyl)ethyl]-2-[2-(3-methylanilino)-2-oxoethyl]sulfanylacetamide Traditional Name: 2-[[2-keto-2-(m-toluidino)ethyl]thio]-N-[2-(2-methoxy-5-methyl-phenyl)ethyl]acetamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NCCC2=C(C=CC(=C2)C)OC

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NCCC2=C(C=CC(=C2)C)OC

InChI

InChI=1S/C21H26N2O3S/c1-15-5-4-6-18(12-15)23-21(25)14-27-13-20(24)22-10-9-17-11-16(2)7-8-19(17)26-3/h4-8,11-12H,9-10,13-14H2,1-3H3,(H,22,24)(H,23,25)