3-(3,5-dimethyl-4-pyrrolidin-1-ylsulfonyl-pyrazol-1-yl)-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(3,5-dimethyl-4-pyrrolidin-1-ylsulfonyl-pyrazol-1-yl)-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: 3-(3,5-dimethyl-4-pyrrolidin-1-ylsulfonyl-pyrazol-1-yl)-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: 3-[3,5-dimethyl-4-(1-pyrrolidinylsulfonyl)-1-pyrazolyl]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: 3-(3,5-dimethyl-4-pyrrolidin-1-ylsulfonylpyrazol-1-yl)-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: 3-(3,5-dimethyl-4-pyrrolidinosulfonyl-pyrazol-1-yl)-1-(4-phenylpiperazino)propan-1-one Formula: C22H31N5O3S MolecularWeight: 445.57824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)N2CCN(CC2)C3=CC=CC=C3)C)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)N2CCN(CC2)C3=CC=CC=C3)C)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H31N5O3S/c1-18-22(31(29,30)26-11-6-7-12-26)19(2)27(23-18)13-10-21(28)25-16-14-24(15-17-25)20-8-4-3-5-9-20/h3-5,8-9H,6-7,10-17H2,1-2H3