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

Systemtic Name: methyl N-[4-methyl-2-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]sulfamate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl N-[4-methyl-2-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]sulfamate Traditional Name: N-[2-(3-isopropylsulfonylpiperazino)-4-methyl-phenyl]sulfamic acid methyl ester Formula: C15H25N3O5S2 MolecularWeight: 391.5061

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)OC)N2CCNC(C2)S(=O)(=O)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)OC)N2CCNC(C2)S(=O)(=O)C(C)C

InChI

InChI=1S/C15H25N3O5S2/c1-11(2)24(19,20)15-10-18(8-7-16-15)14-9-12(3)5-6-13(14)17-25(21,22)23-4/h5-6,9,11,15-17H,7-8,10H2,1-4H3