N-[1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-4-propyl-benzenesulfonamide

Systemtic Name: N-[1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-4-propyl-benzenesulfonamide Openeye Name: N-[1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-4-propyl-benzenesulfonamide CAS Name: N-[1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-4-propylbenzenesulfonamide IUPAC Name: N-[1-[(3,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-4-propylbenzenesulfonamide Traditional Name: N-[1-(3,4-dichlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]-4-propyl-benzenesulfonamide Formula: C21H23Cl2N3O2S MolecularWeight: 452.39722

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(N(N=C2C)CC3=CC(=C(C=C3)Cl)Cl)C

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(N(N=C2C)CC3=CC(=C(C=C3)Cl)Cl)C

InChI

InChI=1S/C21H23Cl2N3O2S/c1-4-5-16-6-9-18(10-7-16)29(27,28)25-21-14(2)24-26(15(21)3)13-17-8-11-19(22)20(23)12-17/h6-12,25H,4-5,13H2,1-3H3