3-[4-ethyl-5-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]-N-phenyl-propanamide

Systemtic Name: 3-[4-ethyl-5-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]-N-phenyl-propanamide Openeye Name: 3-[4-ethyl-5-[2-(2-methylanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]-N-phenyl-propanamide CAS Name: 3-[4-ethyl-5-[[2-(2-methylanilino)-2-oxoethyl]thio]-1,2,4-triazol-3-yl]-N-phenylpropanamide IUPAC Name: 3-[4-ethyl-5-[2-(2-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]-N-phenylpropanamide Traditional Name: 3-[4-ethyl-5-[[2-keto-2-(o-toluidino)ethyl]thio]-1,2,4-triazol-3-yl]-N-phenyl-propionamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2C)CCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2C)CCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H25N5O2S/c1-3-27-19(13-14-20(28)23-17-10-5-4-6-11-17)25-26-22(27)30-15-21(29)24-18-12-8-7-9-16(18)2/h4-12H,3,13-15H2,1-2H3,(H,23,28)(H,24,29)