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

Systemtic Name: N-hexyl-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide Openeye Name: N-hexyl-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-propanamide CAS Name: N-hexyl-2-[[2-(4-methylanilino)-2-oxoethyl]thio]propanamide IUPAC Name: N-hexyl-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanamide Traditional Name: N-hexyl-2-[[2-keto-2-(p-toluidino)ethyl]thio]propionamide Formula: C18H28N2O2S MolecularWeight: 336.49212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C(C)SCC(=O)NC1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCNC(=O)C(C)SCC(=O)NC1=CC=C(C=C1)C

InChI

InChI=1S/C18H28N2O2S/c1-4-5-6-7-12-19-18(22)15(3)23-13-17(21)20-16-10-8-14(2)9-11-16/h8-11,15H,4-7,12-13H2,1-3H3,(H,19,22)(H,20,21)