1-(azepan-1-yl)-2-[[4-ethyl-5-(3-methoxy-1-methyl-pyrazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[[4-ethyl-5-(3-methoxy-1-methyl-pyrazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[[4-ethyl-5-(3-methoxy-1-methyl-pyrazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(1-azepanyl)-2-[[4-ethyl-5-(3-methoxy-1-methyl-4-pyrazolyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[[4-ethyl-5-(3-methoxy-1-methylpyrazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[[4-ethyl-5-(3-methoxy-1-methyl-pyrazol-4-yl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C17H26N6O2S MolecularWeight: 378.49234

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)N2CCCCCC2)C3=CN(N=C3OC)C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N2CCCCCC2)C3=CN(N=C3OC)C

InChI

InChI=1S/C17H26N6O2S/c1-4-23-15(13-11-21(2)20-16(13)25-3)18-19-17(23)26-12-14(24)22-9-7-5-6-8-10-22/h11H,4-10,12H2,1-3H3