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

Systemtic Name: N-tert-butyl-2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-tert-butyl-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-tert-butyl-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-N-tert-butyl-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-benzyl-N-tert-butyl-2-[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C18H26N4O2S MolecularWeight: 362.48964

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC(=O)N(CC2=CC=CC=C2)C(C)(C)C

Isomeric SMILES

CCCN1C(=O)NN=C1SCC(=O)N(CC2=CC=CC=C2)C(C)(C)C

InChI

InChI=1S/C18H26N4O2S/c1-5-11-21-16(24)19-20-17(21)25-13-15(23)22(18(2,3)4)12-14-9-7-6-8-10-14/h6-10H,5,11-13H2,1-4H3,(H,19,24)