(2S)-2-[4-[2,5-bis(bromanyl)phenyl]sulfonylpiperazin-1-yl]-N-cyclopropyl-propanamide

Systemtic Name: (2S)-2-[4-[2,5-bis(bromanyl)phenyl]sulfonylpiperazin-1-yl]-N-cyclopropyl-propanamide Openeye Name: (2S)-N-cyclopropyl-2-[4-(2,5-dibromophenyl)sulfonylpiperazin-1-yl]propanamide CAS Name: (2S)-N-cyclopropyl-2-[4-(2,5-dibromophenyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: (2S)-N-cyclopropyl-2-[4-(2,5-dibromophenyl)sulfonylpiperazin-1-yl]propanamide Traditional Name: (2S)-N-cyclopropyl-2-[4-(2,5-dibromophenyl)sulfonylpiperazino]propionamide Formula: C16H21Br2N3O3S MolecularWeight: 495.22924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Br)Br

Isomeric SMILES

C[C@@H](C(=O)NC1CC1)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Br)Br

InChI

InChI=1S/C16H21Br2N3O3S/c1-11(16(22)19-13-3-4-13)20-6-8-21(9-7-20)25(23,24)15-10-12(17)2-5-14(15)18/h2,5,10-11,13H,3-4,6-9H2,1H3,(H,19,22)/t11-/m0/s1