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

Systemtic Name: phenyl N-[2-(4-methylphenyl)-2-(3-propan-2-ylsulfonylpiperazin-1-yl)ethyl]sulfamate Openeye Name: phenyl N-[2-(3-isopropylsulfonylpiperazin-1-yl)-2-(p-tolyl)ethyl]sulfamate CAS Name: N-[2-(4-methylphenyl)-2-(3-propan-2-ylsulfonyl-1-piperazinyl)ethyl]sulfamic acid phenyl ester IUPAC Name: phenyl N-[2-(4-methylphenyl)-2-(3-propan-2-ylsulfonylpiperazin-1-yl)ethyl]sulfamate Traditional Name: N-[2-(3-isopropylsulfonylpiperazino)-2-(p-tolyl)ethyl]sulfamic acid phenyl ester Formula: C22H31N3O5S2 MolecularWeight: 481.62864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNS(=O)(=O)OC2=CC=CC=C2)N3CCNC(C3)S(=O)(=O)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(CNS(=O)(=O)OC2=CC=CC=C2)N3CCNC(C3)S(=O)(=O)C(C)C

InChI

InChI=1S/C22H31N3O5S2/c1-17(2)31(26,27)22-16-25(14-13-23-22)21(19-11-9-18(3)10-12-19)15-24-32(28,29)30-20-7-5-4-6-8-20/h4-12,17,21-24H,13-16H2,1-3H3