1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one

Systemtic Name: 1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one Openeye Name: 1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one CAS Name: 1-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-3-(3,4-dimethoxyphenyl)-1-propanone IUPAC Name: 1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one Traditional Name: 1-[4-(4-tert-butylphenyl)sulfonylpiperazino]-3-(3,4-dimethoxyphenyl)propan-1-one Formula: C25H34N2O5S MolecularWeight: 474.61286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C25H34N2O5S/c1-25(2,3)20-8-10-21(11-9-20)33(29,30)27-16-14-26(15-17-27)24(28)13-7-19-6-12-22(31-4)23(18-19)32-5/h6,8-12,18H,7,13-17H2,1-5H3