N-[(4-fluorophenyl)methyl]-6,7-dimethoxy-3-(4-methoxyphenyl)sulfonyl-quinolin-4-amine

Systemtic Name: N-[(4-fluorophenyl)methyl]-6,7-dimethoxy-3-(4-methoxyphenyl)sulfonyl-quinolin-4-amine Openeye Name: N-[(4-fluorophenyl)methyl]-6,7-dimethoxy-3-(4-methoxyphenyl)sulfonyl-quinolin-4-amine CAS Name: N-[(4-fluorophenyl)methyl]-6,7-dimethoxy-3-(4-methoxyphenyl)sulfonyl-4-quinolinamine IUPAC Name: N-[(4-fluorophenyl)methyl]-6,7-dimethoxy-3-(4-methoxyphenyl)sulfonylquinolin-4-amine Traditional Name: [6,7-dimethoxy-3-(4-methoxyphenyl)sulfonyl-4-quinolyl]-(4-fluorobenzyl)amine Formula: C25H23FN2O5S MolecularWeight: 482.523923

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C2=C(C3=CC(=C(C=C3N=C2)OC)OC)NCC4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C2=C(C3=CC(=C(C=C3N=C2)OC)OC)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C25H23FN2O5S/c1-31-18-8-10-19(11-9-18)34(29,30)24-15-27-21-13-23(33-3)22(32-2)12-20(21)25(24)28-14-16-4-6-17(26)7-5-16/h4-13,15H,14H2,1-3H3,(H,27,28)