N-(4-butoxyphenyl)-2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(4-butoxyphenyl)-2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(4-butoxyphenyl)-2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(4-butoxyphenyl)-2-[[2-(3-methylanilino)-2-oxoethyl]thio]acetamide IUPAC Name: N-(4-butoxyphenyl)-2-[2-(3-methylanilino)-2-oxoethyl]sulfanylacetamide Traditional Name: N-(4-butoxyphenyl)-2-[[2-keto-2-(m-toluidino)ethyl]thio]acetamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=CC=CC(=C2)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=CC=CC(=C2)C

InChI

InChI=1S/C21H26N2O3S/c1-3-4-12-26-19-10-8-17(9-11-19)22-20(24)14-27-15-21(25)23-18-7-5-6-16(2)13-18/h5-11,13H,3-4,12,14-15H2,1-2H3,(H,22,24)(H,23,25)