2,5-bis(chloranyl)-N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]thiophene-3-sulfonamide

Systemtic Name: 2,5-bis(chloranyl)-N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]thiophene-3-sulfonamide Openeye Name: 2,5-dichloro-N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]thiophene-3-sulfonamide CAS Name: 2,5-dichloro-N-[1-(3-methoxy-3-methylbutyl)-4-pyrazolyl]-3-thiophenesulfonamide IUPAC Name: 2,5-dichloro-N-[1-(3-methoxy-3-methylbutyl)pyrazol-4-yl]thiophene-3-sulfonamide Traditional Name: 2,5-dichloro-N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]thiophene-3-sulfonamide Formula: C13H17Cl2N3O3S2 MolecularWeight: 398.32838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCN1C=C(C=N1)NS(=O)(=O)C2=C(SC(=C2)Cl)Cl)OC

Isomeric SMILES

CC(C)(CCN1C=C(C=N1)NS(=O)(=O)C2=C(SC(=C2)Cl)Cl)OC

InChI

InChI=1S/C13H17Cl2N3O3S2/c1-13(2,21-3)4-5-18-8-9(7-16-18)17-23(19,20)10-6-11(14)22-12(10)15/h6-8,17H,4-5H2,1-3H3