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

Systemtic Name: ethyl N-[4-methyl-2-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]sulfamate Openeye Name: ethyl N-[2-(3-isopropylsulfonylpiperazin-1-yl)-4-methyl-phenyl]sulfamate CAS Name: N-[4-methyl-2-(3-propan-2-ylsulfonyl-1-piperazinyl)phenyl]sulfamic acid ethyl ester IUPAC Name: ethyl N-[4-methyl-2-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]sulfamate Traditional Name: N-[2-(3-isopropylsulfonylpiperazino)-4-methyl-phenyl]sulfamic acid ethyl ester Formula: C16H27N3O5S2 MolecularWeight: 405.53268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27N3O5S2/c1-5-24-26(22,23)18-14-7-6-13(4)10-15(14)19-9-8-17-16(11-19)25(20,21)12(2)3/h6-7,10,12,16-18H,5,8-9,11H2,1-4H3