N-heptan-2-yl-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide

Systemtic Name: N-heptan-2-yl-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide Openeye Name: 2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-N-(1-methylhexyl)propanamide CAS Name: N-heptan-2-yl-2-[[2-(4-methylanilino)-2-oxoethyl]thio]propanamide IUPAC Name: N-heptan-2-yl-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanamide Traditional Name: 2-[[2-keto-2-(p-toluidino)ethyl]thio]-N-(1-methylhexyl)propionamide Formula: C19H30N2O2S MolecularWeight: 350.5187

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C(C)SCC(=O)NC1=CC=C(C=C1)C

Isomeric SMILES

CCCCCC(C)NC(=O)C(C)SCC(=O)NC1=CC=C(C=C1)C

InChI

InChI=1S/C19H30N2O2S/c1-5-6-7-8-15(3)20-19(23)16(4)24-13-18(22)21-17-11-9-14(2)10-12-17/h9-12,15-16H,5-8,13H2,1-4H3,(H,20,23)(H,21,22)