1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-one

Systemtic Name: 1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-one Openeye Name: 1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-one CAS Name: 1-[4-(3-bromophenyl)sulfonyl-1-piperazinyl]-3-(1,3,5-trimethyl-4-pyrazolyl)-1-propanone IUPAC Name: 1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-one Traditional Name: 1-[4-(3-bromophenyl)sulfonylpiperazino]-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-one Formula: C19H25BrN4O3S MolecularWeight: 469.3958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC1=C(C(=NN1C)C)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H25BrN4O3S/c1-14-18(15(2)22(3)21-14)7-8-19(25)23-9-11-24(12-10-23)28(26,27)17-6-4-5-16(20)13-17/h4-6,13H,7-12H2,1-3H3