ethyl N-[2-(3-fluoranylpiperazin-1-yl)-4-methyl-phenyl]sulfamate

Systemtic Name: ethyl N-[2-(3-fluoranylpiperazin-1-yl)-4-methyl-phenyl]sulfamate Openeye Name: ethyl N-[2-(3-fluoropiperazin-1-yl)-4-methyl-phenyl]sulfamate CAS Name: N-[2-(3-fluoro-1-piperazinyl)-4-methylphenyl]sulfamic acid ethyl ester IUPAC Name: ethyl N-[2-(3-fluoropiperazin-1-yl)-4-methylphenyl]sulfamate Traditional Name: N-[2-(3-fluoropiperazino)-4-methyl-phenyl]sulfamic acid ethyl ester Formula: C13H20FN3O3S MolecularWeight: 317.379603

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Descriptors Computed from Structure

Canonical SMILES:

CCOS(=O)(=O)NC1=C(C=C(C=C1)C)N2CCNC(C2)F

Isomeric SMILES

CCOS(=O)(=O)NC1=C(C=C(C=C1)C)N2CCNC(C2)F

InChI

InChI=1S/C13H20FN3O3S/c1-3-20-21(18,19)16-11-5-4-10(2)8-12(11)17-7-6-15-13(14)9-17/h4-5,8,13,15-16H,3,6-7,9H2,1-2H3