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

Systemtic Name: 3-[4-ethyl-5-[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-ethyl-5-[2-(o-tolylmethylamino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-ethyl-5-[[2-[(2-methylphenyl)methylamino]-2-oxoethyl]thio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-ethyl-5-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-ethyl-5-[[2-keto-2-[(2-methylbenzyl)amino]ethyl]thio]-1,2,4-triazol-3-yl]propionamide Formula: C17H23N5O2S MolecularWeight: 361.46182

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NCC2=CC=CC=C2C)CCC(=O)N

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NCC2=CC=CC=C2C)CCC(=O)N

InChI

InChI=1S/C17H23N5O2S/c1-3-22-15(9-8-14(18)23)20-21-17(22)25-11-16(24)19-10-13-7-5-4-6-12(13)2/h4-7H,3,8-11H2,1-2H3,(H2,18,23)(H,19,24)