2-[(2-dodecanoyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethylphenyl)ethanamide

Systemtic Name: 2-[(2-dodecanoyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethylphenyl)ethanamide Openeye Name: 2-[(2-dodecanoyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethylphenyl)acetamide CAS Name: N-(2-ethylphenyl)-2-[[2-(1-oxododecyl)-5-phenyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[(2-dodecanoyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethylphenyl)acetamide Traditional Name: N-(2-ethylphenyl)-2-[(2-lauroyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C30H40N4O2S MolecularWeight: 520.7292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)N1C(=NC(=N1)C2=CC=CC=C2)SCC(=O)NC3=CC=CC=C3CC

Isomeric SMILES

CCCCCCCCCCCC(=O)N1C(=NC(=N1)C2=CC=CC=C2)SCC(=O)NC3=CC=CC=C3CC

InChI

InChI=1S/C30H40N4O2S/c1-3-5-6-7-8-9-10-11-15-22-28(36)34-30(32-29(33-34)25-19-13-12-14-20-25)37-23-27(35)31-26-21-17-16-18-24(26)4-2/h12-14,16-21H,3-11,15,22-23H2,1-2H3,(H,31,35)