3-[4-ethyl-5-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylphenyl)amino]ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-ethyl-5-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylphenyl)amino]ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-ethyl-5-[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-ethyl-5-[[2-oxo-2-[4-(1-pyrrolidinyl)anilino]ethyl]thio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-ethyl-5-[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-ethyl-5-[[2-keto-2-(4-pyrrolidinoanilino)ethyl]thio]-1,2,4-triazol-3-yl]propionamide Formula: C19H26N6O2S MolecularWeight: 402.51374

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)N3CCCC3)CCC(=O)N

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)N3CCCC3)CCC(=O)N

InChI

InChI=1S/C19H26N6O2S/c1-2-25-17(10-9-16(20)26)22-23-19(25)28-13-18(27)21-14-5-7-15(8-6-14)24-11-3-4-12-24/h5-8H,2-4,9-13H2,1H3,(H2,20,26)(H,21,27)