4-(5-azanyl-3-propan-2-yl-pyrazol-1-yl)-2,5-bis(chloranyl)-N-(2-ethylhexyl)benzenesulfonamide

Systemtic Name: 4-(5-azanyl-3-propan-2-yl-pyrazol-1-yl)-2,5-bis(chloranyl)-N-(2-ethylhexyl)benzenesulfonamide Openeye Name: 4-(5-amino-3-isopropyl-pyrazol-1-yl)-2,5-dichloro-N-(2-ethylhexyl)benzenesulfonamide CAS Name: 4-(5-amino-3-propan-2-yl-1-pyrazolyl)-2,5-dichloro-N-(2-ethylhexyl)benzenesulfonamide IUPAC Name: 4-(5-amino-3-propan-2-ylpyrazol-1-yl)-2,5-dichloro-N-(2-ethylhexyl)benzenesulfonamide Traditional Name: 4-(5-amino-3-isopropyl-pyrazol-1-yl)-2,5-dichloro-N-(2-ethylhexyl)benzenesulfonamide Formula: C20H30Cl2N4O2S MolecularWeight: 461.4488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNS(=O)(=O)C1=C(C=C(C(=C1)Cl)N2C(=CC(=N2)C(C)C)N)Cl

Isomeric SMILES

CCCCC(CC)CNS(=O)(=O)C1=C(C=C(C(=C1)Cl)N2C(=CC(=N2)C(C)C)N)Cl

InChI

InChI=1S/C20H30Cl2N4O2S/c1-5-7-8-14(6-2)12-24-29(27,28)19-10-15(21)18(9-16(19)22)26-20(23)11-17(25-26)13(3)4/h9-11,13-14,24H,5-8,12,23H2,1-4H3