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

Systemtic Name: 1-[4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]-4-morpholin-4-yl-butane-1,4-dione Openeye Name: 1-[4-(4-bromo-3-methyl-phenyl)sulfonylpiperazin-1-yl]-4-morpholino-butane-1,4-dione CAS Name: 1-[4-(4-bromo-3-methylphenyl)sulfonyl-1-piperazinyl]-4-(4-morpholinyl)butane-1,4-dione IUPAC Name: 1-[4-(4-bromo-3-methylphenyl)sulfonylpiperazin-1-yl]-4-morpholin-4-ylbutane-1,4-dione Traditional Name: 1-[4-(4-bromo-3-methyl-phenyl)sulfonylpiperazino]-4-morpholino-butane-1,4-dione Formula: C19H26BrN3O5S MolecularWeight: 488.39584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26BrN3O5S/c1-15-14-16(2-3-17(15)20)29(26,27)23-8-6-21(7-9-23)18(24)4-5-19(25)22-10-12-28-13-11-22/h2-3,14H,4-13H2,1H3