[2,6-di(propan-2-yl)phenyl] N-(4-methylpiperazin-1-yl)sulfonylcarbamate hydrochloride

Systemtic Name: [2,6-di(propan-2-yl)phenyl] N-(4-methylpiperazin-1-yl)sulfonylcarbamate hydrochloride Openeye Name: (2,6-diisopropylphenyl) N-(4-methylpiperazin-1-yl)sulfonylcarbamate hydrochloride CAS Name: N-[(4-methyl-1-piperazinyl)sulfonyl]carbamic acid [2,6-di(propan-2-yl)phenyl] ester hydrochloride IUPAC Name: [2,6-di(propan-2-yl)phenyl] N-(4-methylpiperazin-1-yl)sulfonylcarbamate hydrochloride Traditional Name: N-(4-methylpiperazino)sulfonylcarbamic acid (2,6-diisopropylphenyl) ester hydrochloride Formula: C18H30ClN3O4S MolecularWeight: 419.9665

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)OC(=O)NS(=O)(=O)N2CCN(CC2)C.Cl

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)OC(=O)NS(=O)(=O)N2CCN(CC2)C.Cl

InChI

InChI=1S/C18H29N3O4S.ClH/c1-13(2)15-7-6-8-16(14(3)4)17(15)25-18(22)19-26(23,24)21-11-9-20(5)10-12-21;/h6-8,13-14H,9-12H2,1-5H3,(H,19,22);1H