2-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)ethanamide

Systemtic Name: 2-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)ethanamide Openeye Name: 2-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)acetamide CAS Name: 2-[[5-(butylthio)-1,3,4-thiadiazol-2-yl]thio]-N-(5-cyclopropyl-2-phenyl-3-pyrazolyl)acetamide IUPAC Name: 2-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-cyclopropyl-2-phenylpyrazol-3-yl)acetamide Traditional Name: 2-[[5-(butylthio)-1,3,4-thiadiazol-2-yl]thio]-N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)acetamide Formula: C20H23N5OS3 MolecularWeight: 445.62452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(S1)SCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C4CC4

Isomeric SMILES

CCCCSC1=NN=C(S1)SCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C20H23N5OS3/c1-2-3-11-27-19-22-23-20(29-19)28-13-18(26)21-17-12-16(14-9-10-14)24-25(17)15-7-5-4-6-8-15/h4-8,12,14H,2-3,9-11,13H2,1H3,(H,21,26)