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

Systemtic Name: 2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-pentyl-propanamide Openeye Name: 2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-N-pentyl-propanamide CAS Name: 2-[[2-(4-methylanilino)-2-oxoethyl]thio]-N-pentylpropanamide IUPAC Name: 2-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-N-pentylpropanamide Traditional Name: N-amyl-2-[[2-keto-2-(p-toluidino)ethyl]thio]propionamide Formula: C17H26N2O2S MolecularWeight: 322.46554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O2S/c1-4-5-6-11-18-17(21)14(3)22-12-16(20)19-15-9-7-13(2)8-10-15/h7-10,14H,4-6,11-12H2,1-3H3,(H,18,21)(H,19,20)