N-heptan-2-yl-1,3,5-trimethyl-pyrazole-4-sulfonamide

Systemtic Name: N-heptan-2-yl-1,3,5-trimethyl-pyrazole-4-sulfonamide Openeye Name: 1,3,5-trimethyl-N-(1-methylhexyl)pyrazole-4-sulfonamide CAS Name: N-heptan-2-yl-1,3,5-trimethyl-4-pyrazolesulfonamide IUPAC Name: N-heptan-2-yl-1,3,5-trimethylpyrazole-4-sulfonamide Traditional Name: 1,3,5-trimethyl-N-(1-methylhexyl)pyrazole-4-sulfonamide Formula: C13H25N3O2S MolecularWeight: 287.4215

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NS(=O)(=O)C1=C(N(N=C1C)C)C

Isomeric SMILES

CCCCCC(C)NS(=O)(=O)C1=C(N(N=C1C)C)C

InChI

InChI=1S/C13H25N3O2S/c1-6-7-8-9-10(2)15-19(17,18)13-11(3)14-16(5)12(13)4/h10,15H,6-9H2,1-5H3