N-(1-methyl-3-pyridin-2-yl-pyrazol-4-yl)-11-sulfanyl-undecanamide

Systemtic Name: N-(1-methyl-3-pyridin-2-yl-pyrazol-4-yl)-11-sulfanyl-undecanamide Openeye Name: N-[1-methyl-3-(2-pyridyl)pyrazol-4-yl]-11-sulfanyl-undecanamide CAS Name: 11-mercapto-N-[1-methyl-3-(2-pyridinyl)-4-pyrazolyl]undecanamide IUPAC Name: N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-11-sulfanylundecanamide Traditional Name: 11-mercapto-N-[1-methyl-3-(2-pyridyl)pyrazol-4-yl]undecanamide Formula: C20H30N4OS MolecularWeight: 374.5434

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=CC=N2)NC(=O)CCCCCCCCCCS

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=CC=N2)NC(=O)CCCCCCCCCCS

InChI

InChI=1S/C20H30N4OS/c1-24-16-18(20(23-24)17-12-9-10-14-21-17)22-19(25)13-8-6-4-2-3-5-7-11-15-26/h9-10,12,14,16,26H,2-8,11,13,15H2,1H3,(H,22,25)