N-[5-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-methoxy-1-methyl-pyrazole-4-carboxamide

Systemtic Name: N-[5-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-methoxy-1-methyl-pyrazole-4-carboxamide Openeye Name: N-[5-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-methoxy-1-methyl-pyrazole-4-carboxamide CAS Name: N-[5-[[2-(1-azepanyl)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-3-methoxy-1-methyl-4-pyrazolecarboxamide IUPAC Name: N-[5-[2-(azepan-1-yl)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-methoxy-1-methylpyrazole-4-carboxamide Traditional Name: N-[5-[[2-(azepan-1-yl)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]-3-methoxy-1-methyl-pyrazole-4-carboxamide Formula: C16H22N6O3S2 MolecularWeight: 410.51428

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)OC)C(=O)NC2=NN=C(S2)SCC(=O)N3CCCCCC3

Isomeric SMILES

CN1C=C(C(=N1)OC)C(=O)NC2=NN=C(S2)SCC(=O)N3CCCCCC3

InChI

InChI=1S/C16H22N6O3S2/c1-21-9-11(14(20-21)25-2)13(24)17-15-18-19-16(27-15)26-10-12(23)22-7-5-3-4-6-8-22/h9H,3-8,10H2,1-2H3,(H,17,18,24)