1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-7-(5-methylthiophen-2-yl)heptane-1,4,7-trione

Systemtic Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-7-(5-methylthiophen-2-yl)heptane-1,4,7-trione Openeye Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-7-(5-methyl-2-thienyl)heptane-1,4,7-trione CAS Name: 1-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-7-(5-methyl-2-thiophenyl)heptane-1,4,7-trione IUPAC Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-7-(5-methylthiophen-2-yl)heptane-1,4,7-trione Traditional Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazino]-7-(5-methyl-2-thienyl)heptane-1,4,7-trione Formula: C24H30N2O5S2 MolecularWeight: 490.6354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)CCC(=O)C3=CC=C(S3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)CCC(=O)C3=CC=C(S3)C)C

InChI

InChI=1S/C24H30N2O5S2/c1-17-4-10-23(18(2)16-17)33(30,31)26-14-12-25(13-15-26)24(29)11-7-20(27)6-8-21(28)22-9-5-19(3)32-22/h4-5,9-10,16H,6-8,11-15H2,1-3H3