N-(3-heptadecyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-(3-heptadecyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-(3-heptadecyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide CAS Name: N-(3-heptadecyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-(3-heptadecyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-(3-heptadecyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C21H40N4OS MolecularWeight: 396.6335

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=NNC(=S)N1NC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=NNC(=S)N1NC(=O)C

InChI

InChI=1S/C21H40N4OS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-22-23-21(27)25(20)24-19(2)26/h3-18H2,1-2H3,(H,23,27)(H,24,26)