N-(4-cyano-2-methyl-pyrazol-3-yl)-2-[[4-ethyl-5-(phenylsulfonylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-[[4-ethyl-5-(phenylsulfonylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-(benzenesulfonylmethyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-cyano-2-methyl-pyrazol-3-yl)acetamide CAS Name: 2-[[5-(benzenesulfonylmethyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-(4-cyano-2-methyl-3-pyrazolyl)acetamide IUPAC Name: 2-[[5-(benzenesulfonylmethyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-cyano-2-methylpyrazol-3-yl)acetamide Traditional Name: 2-[[5-(besylmethyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-(4-cyano-2-methyl-pyrazol-3-yl)acetamide Formula: C18H19N7O3S2 MolecularWeight: 445.51856

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=C(C=NN2C)C#N)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=C(C=NN2C)C#N)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H19N7O3S2/c1-3-25-15(12-30(27,28)14-7-5-4-6-8-14)22-23-18(25)29-11-16(26)21-17-13(9-19)10-20-24(17)2/h4-8,10H,3,11-12H2,1-2H3,(H,21,26)