N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-[[5-(phenylsulfanylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-[[5-(phenylsulfanylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(phenylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-cyano-2-phenyl-pyrazol-3-yl)acetamide CAS Name: N-(4-cyano-2-phenyl-3-pyrazolyl)-2-[[5-[(phenylthio)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-cyano-2-phenylpyrazol-3-yl)-2-[[5-(phenylsulfanylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-[(phenylthio)methyl]-1,2,4-triazol-3-yl]thio]-N-(4-cyano-2-phenyl-pyrazol-3-yl)acetamide Formula: C24H21N7OS2 MolecularWeight: 487.59984

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)NC2=C(C=NN2C3=CC=CC=C3)C#N)CSC4=CC=CC=C4

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NC2=C(C=NN2C3=CC=CC=C3)C#N)CSC4=CC=CC=C4

InChI

InChI=1S/C24H21N7OS2/c1-2-13-30-21(16-33-20-11-7-4-8-12-20)28-29-24(30)34-17-22(32)27-23-18(14-25)15-26-31(23)19-9-5-3-6-10-19/h2-12,15H,1,13,16-17H2,(H,27,32)