N-tert-butyl-2-[(5-oxidanylidene-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-tert-butyl-2-[(5-oxidanylidene-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-tert-butyl-2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-tert-butyl-2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-tert-butyl-2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-tert-butyl-2-[(5-keto-4-phenethyl-1H-1,2,4-triazol-3-yl)thio]propionamide Formula: C17H24N4O2S MolecularWeight: 348.46306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)SC1=NNC(=O)N1CCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC(C)(C)C)SC1=NNC(=O)N1CCC2=CC=CC=C2

InChI

InChI=1S/C17H24N4O2S/c1-12(14(22)18-17(2,3)4)24-16-20-19-15(23)21(16)11-10-13-8-6-5-7-9-13/h5-9,12H,10-11H2,1-4H3,(H,18,22)(H,19,23)