1-[4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]-2-morpholin-4-yl-ethane-1,2-dione

Systemtic Name: 1-[4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]-2-morpholin-4-yl-ethane-1,2-dione Openeye Name: 1-[4-(4-bromo-3-methyl-phenyl)sulfonylpiperazin-1-yl]-2-morpholino-ethane-1,2-dione CAS Name: 1-[4-(4-bromo-3-methylphenyl)sulfonyl-1-piperazinyl]-2-(4-morpholinyl)ethane-1,2-dione IUPAC Name: 1-[4-(4-bromo-3-methylphenyl)sulfonylpiperazin-1-yl]-2-morpholin-4-ylethane-1,2-dione Traditional Name: 1-[4-(4-bromo-3-methyl-phenyl)sulfonylpiperazino]-2-morpholino-ethane-1,2-dione Formula: C17H22BrN3O5S MolecularWeight: 460.34268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(=O)N3CCOCC3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(=O)N3CCOCC3)Br

InChI

InChI=1S/C17H22BrN3O5S/c1-13-12-14(2-3-15(13)18)27(24,25)21-6-4-19(5-7-21)16(22)17(23)20-8-10-26-11-9-20/h2-3,12H,4-11H2,1H3