1-[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazin-1-yl]-3-(furan-2-yl)propan-1-one

Systemtic Name: 1-[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazin-1-yl]-3-(furan-2-yl)propan-1-one Openeye Name: 1-[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazin-1-yl]-3-(2-furyl)propan-1-one CAS Name: 1-[4-(4-tert-butyl-2,6-dimethylphenyl)sulfonyl-1-piperazinyl]-3-(2-furanyl)-1-propanone IUPAC Name: 1-[4-(4-tert-butyl-2,6-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(furan-2-yl)propan-1-one Traditional Name: 1-[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazino]-3-(2-furyl)propan-1-one Formula: C23H32N2O4S MolecularWeight: 432.57618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC=CO3)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC=CO3)C)C(C)(C)C

InChI

InChI=1S/C23H32N2O4S/c1-17-15-19(23(3,4)5)16-18(2)22(17)30(27,28)25-12-10-24(11-13-25)21(26)9-8-20-7-6-14-29-20/h6-7,14-16H,8-13H2,1-5H3