3-(3-fluoranyl-4-methoxy-phenyl)-4-(phenylmethoxymethyl)-6-(phenylmethyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide

Systemtic Name: 3-(3-fluoranyl-4-methoxy-phenyl)-4-(phenylmethoxymethyl)-6-(phenylmethyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide Openeye Name: 6-benzyl-4-(benzyloxymethyl)-3-(3-fluoro-4-methoxy-phenyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide CAS Name: 3-(3-fluoro-4-methoxyphenyl)-4-(phenylmethoxymethyl)-6-(phenylmethyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide IUPAC Name: 6-benzyl-3-(3-fluoro-4-methoxyphenyl)-4-(phenylmethoxymethyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide Traditional Name: 4-(benzoxymethyl)-6-benzyl-3-(3-fluoro-4-methoxy-phenyl)-2-(1H-pyrazol-5-yl)benzenesulfonamide Formula: C31H28FN3O4S MolecularWeight: 557.635123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=C(C=C2COCC3=CC=CC=C3)CC4=CC=CC=C4)S(=O)(=O)N)C5=CC=NN5)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=C(C=C2COCC3=CC=CC=C3)CC4=CC=CC=C4)S(=O)(=O)N)C5=CC=NN5)F

InChI

InChI=1S/C31H28FN3O4S/c1-38-28-13-12-23(18-26(28)32)29-25(20-39-19-22-10-6-3-7-11-22)17-24(16-21-8-4-2-5-9-21)31(40(33,36)37)30(29)27-14-15-34-35-27/h2-15,17-18H,16,19-20H2,1H3,(H,34,35)(H2,33,36,37)