1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-(2,5-dimethylthiophen-3-yl)butane-1,4-dione

Systemtic Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-(2,5-dimethylthiophen-3-yl)butane-1,4-dione Openeye Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-(2,5-dimethyl-3-thienyl)butane-1,4-dione CAS Name: 1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-4-(2,5-dimethyl-3-thiophenyl)butane-1,4-dione IUPAC Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-(2,5-dimethylthiophen-3-yl)butane-1,4-dione Traditional Name: 1-[4-(2,3-dimethylphenyl)piperazino]-4-(2,5-dimethyl-3-thienyl)butane-1,4-dione Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CCC(=O)C3=C(SC(=C3)C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CCC(=O)C3=C(SC(=C3)C)C)C

InChI

InChI=1S/C22H28N2O2S/c1-15-6-5-7-20(17(15)3)23-10-12-24(13-11-23)22(26)9-8-21(25)19-14-16(2)27-18(19)4/h5-7,14H,8-13H2,1-4H3