3-[4-methyl-5-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-methyl-5-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-methyl-5-[2-oxo-2-(2-thienylmethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-methyl-5-[[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]thio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-methyl-5-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[[2-keto-2-(2-thenylamino)ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C13H17N5O2S2 MolecularWeight: 339.43638

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NCC2=CC=CS2)CCC(=O)N

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NCC2=CC=CS2)CCC(=O)N

InChI

InChI=1S/C13H17N5O2S2/c1-18-11(5-4-10(14)19)16-17-13(18)22-8-12(20)15-7-9-3-2-6-21-9/h2-3,6H,4-5,7-8H2,1H3,(H2,14,19)(H,15,20)