1-[(4-ethoxyphenyl)methyl]-4-(2-fluoranyl-5-methyl-phenyl)sulfonyl-piperazine

Systemtic Name: 1-[(4-ethoxyphenyl)methyl]-4-(2-fluoranyl-5-methyl-phenyl)sulfonyl-piperazine Openeye Name: 1-[(4-ethoxyphenyl)methyl]-4-(2-fluoro-5-methyl-phenyl)sulfonyl-piperazine CAS Name: 1-[(4-ethoxyphenyl)methyl]-4-(2-fluoro-5-methylphenyl)sulfonylpiperazine IUPAC Name: 1-[(4-ethoxyphenyl)methyl]-4-(2-fluoro-5-methylphenyl)sulfonylpiperazine Traditional Name: 1-(4-ethoxybenzyl)-4-(2-fluoro-5-methyl-phenyl)sulfonyl-piperazine Formula: C20H25FN2O3S MolecularWeight: 392.487503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)F

Isomeric SMILES

CCOC1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)F

InChI

InChI=1S/C20H25FN2O3S/c1-3-26-18-7-5-17(6-8-18)15-22-10-12-23(13-11-22)27(24,25)20-14-16(2)4-9-19(20)21/h4-9,14H,3,10-13,15H2,1-2H3