[(2S)-1-(4-bromophenyl)sulfonylpiperidin-2-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [(2S)-1-(4-bromophenyl)sulfonylpiperidin-2-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [(2S)-1-(4-bromophenyl)sulfonyl-2-piperidyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [(2S)-1-(4-bromophenyl)sulfonyl-2-piperidinyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [(2S)-1-(4-bromophenyl)sulfonylpiperidin-2-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [(2S)-1-brosyl-2-piperidyl]-(4-phenylpiperazino)methanone Formula: C22H26BrN3O3S MolecularWeight: 492.42914

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)N2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CCN([C@@H](C1)C(=O)N2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H26BrN3O3S/c23-18-9-11-20(12-10-18)30(28,29)26-13-5-4-8-21(26)22(27)25-16-14-24(15-17-25)19-6-2-1-3-7-19/h1-3,6-7,9-12,21H,4-5,8,13-17H2/t21-/m0/s1