2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-cyanocycloheptyl)ethanamide

Systemtic Name: 2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-cyanocycloheptyl)ethanamide Openeye Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-cyanocycloheptyl)acetamide CAS Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-(1-cyanocycloheptyl)acetamide IUPAC Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-cyanocycloheptyl)acetamide Traditional Name: 2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-(1-cyanocycloheptyl)acetamide Formula: C16H25N5O2S MolecularWeight: 351.467

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC(=O)NC2(CCCCCC2)C#N

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC(=O)NC2(CCCCCC2)C#N

InChI

InChI=1S/C16H25N5O2S/c1-2-3-10-21-14(23)19-20-15(21)24-11-13(22)18-16(12-17)8-6-4-5-7-9-16/h2-11H2,1H3,(H,18,22)(H,19,23)