N-[1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]quinoline-8-sulfonamide

Systemtic Name: N-[1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]quinoline-8-sulfonamide Openeye Name: N-[1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]quinoline-8-sulfonamide CAS Name: N-[1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-8-quinolinesulfonamide IUPAC Name: N-[1-[(3,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]quinoline-8-sulfonamide Traditional Name: N-[1-(3,4-dichlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]quinoline-8-sulfonamide Formula: C21H18Cl2N4O2S MolecularWeight: 461.36422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=C(C=C2)Cl)Cl)C)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=C(C=C2)Cl)Cl)C)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H18Cl2N4O2S/c1-13-20(14(2)27(25-13)12-15-8-9-17(22)18(23)11-15)26-30(28,29)19-7-3-5-16-6-4-10-24-21(16)19/h3-11,26H,12H2,1-2H3