[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-(2-ethyl-5-propan-2-yl-pyrazol-3-yl)methanone

Systemtic Name: [4-(3-bromophenyl)sulfonylpiperazin-1-yl]-(2-ethyl-5-propan-2-yl-pyrazol-3-yl)methanone Openeye Name: [4-(3-bromophenyl)sulfonylpiperazin-1-yl]-(2-ethyl-5-isopropyl-pyrazol-3-yl)methanone CAS Name: [4-(3-bromophenyl)sulfonyl-1-piperazinyl]-(2-ethyl-5-propan-2-yl-3-pyrazolyl)methanone IUPAC Name: [4-(3-bromophenyl)sulfonylpiperazin-1-yl]-(2-ethyl-5-propan-2-ylpyrazol-3-yl)methanone Traditional Name: [4-(3-bromophenyl)sulfonylpiperazino]-(2-ethyl-5-isopropyl-pyrazol-3-yl)methanone Formula: C19H25BrN4O3S MolecularWeight: 469.3958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C(C)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCN1C(=CC(=N1)C(C)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H25BrN4O3S/c1-4-24-18(13-17(21-24)14(2)3)19(25)22-8-10-23(11-9-22)28(26,27)16-7-5-6-15(20)12-16/h5-7,12-14H,4,8-11H2,1-3H3