N-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]-2,5-dimethoxy-benzenesulfonamide

Systemtic Name: N-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]-2,5-dimethoxy-benzenesulfonamide Openeye Name: N-(1-benzyl-4-chloro-pyrazol-3-yl)-2,5-dimethoxy-benzenesulfonamide CAS Name: N-[4-chloro-1-(phenylmethyl)-3-pyrazolyl]-2,5-dimethoxybenzenesulfonamide IUPAC Name: N-(1-benzyl-4-chloropyrazol-3-yl)-2,5-dimethoxybenzenesulfonamide Traditional Name: N-(1-benzyl-4-chloro-pyrazol-3-yl)-2,5-dimethoxy-benzenesulfonamide Formula: C18H18ClN3O4S MolecularWeight: 407.87122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2=NN(C=C2Cl)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2=NN(C=C2Cl)CC3=CC=CC=C3

InChI

InChI=1S/C18H18ClN3O4S/c1-25-14-8-9-16(26-2)17(10-14)27(23,24)21-18-15(19)12-22(20-18)11-13-6-4-3-5-7-13/h3-10,12H,11H2,1-2H3,(H,20,21)