N,N-diethyl-3-(oxan-2-ylmethylsulfanyl)-1,2,4-triazole-1-carboxamide

Systemtic Name: N,N-diethyl-3-(oxan-2-ylmethylsulfanyl)-1,2,4-triazole-1-carboxamide Openeye Name: N,N-diethyl-3-(tetrahydropyran-2-ylmethylsulfanyl)-1,2,4-triazole-1-carboxamide CAS Name: N,N-diethyl-3-(2-oxanylmethylthio)-1,2,4-triazole-1-carboxamide IUPAC Name: N,N-diethyl-3-(oxan-2-ylmethylsulfanyl)-1,2,4-triazole-1-carboxamide Traditional Name: N,N-diethyl-3-(tetrahydropyran-2-ylmethylthio)-1,2,4-triazole-1-carboxamide Formula: C13H22N4O2S MolecularWeight: 298.40438

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1C=NC(=N1)SCC2CCCCO2

Isomeric SMILES

CCN(CC)C(=O)N1C=NC(=N1)SCC2CCCCO2

InChI

InChI=1S/C13H22N4O2S/c1-3-16(4-2)13(18)17-10-14-12(15-17)20-9-11-7-5-6-8-19-11/h10-11H,3-9H2,1-2H3