3-azanyl-2-dodecanoyl-5-sulfanylidene-1H-pyrazole-4-carboxamide

Systemtic Name: 3-azanyl-2-dodecanoyl-5-sulfanylidene-1H-pyrazole-4-carboxamide Openeye Name: 3-amino-2-dodecanoyl-5-thioxo-1H-pyrazole-4-carboxamide CAS Name: 3-amino-2-(1-oxododecyl)-5-sulfanylidene-1H-pyrazole-4-carboxamide IUPAC Name: 3-amino-2-dodecanoyl-5-sulfanylidene-1H-pyrazole-4-carboxamide Traditional Name: 5-amino-1-lauroyl-3-thioxo-3-pyrazoline-4-carboxamide Formula: C16H28N4O2S MolecularWeight: 340.48412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)N1C(=C(C(=S)N1)C(=O)N)N

Isomeric SMILES

CCCCCCCCCCCC(=O)N1C(=C(C(=S)N1)C(=O)N)N

InChI

InChI=1S/C16H28N4O2S/c1-2-3-4-5-6-7-8-9-10-11-12(21)20-14(17)13(15(18)22)16(23)19-20/h2-11,17H2,1H3,(H2,18,22)(H,19,23)