1-(5-methylthiophen-2-yl)-7-(4-thiophen-2-ylsulfonylpiperazin-1-yl)heptane-1,4,7-trione

Systemtic Name: 1-(5-methylthiophen-2-yl)-7-(4-thiophen-2-ylsulfonylpiperazin-1-yl)heptane-1,4,7-trione Openeye Name: 1-(5-methyl-2-thienyl)-7-[4-(2-thienylsulfonyl)piperazin-1-yl]heptane-1,4,7-trione CAS Name: 1-(5-methyl-2-thiophenyl)-7-(4-thiophen-2-ylsulfonyl-1-piperazinyl)heptane-1,4,7-trione IUPAC Name: 1-(5-methylthiophen-2-yl)-7-(4-thiophen-2-ylsulfonylpiperazin-1-yl)heptane-1,4,7-trione Traditional Name: 1-(5-methyl-2-thienyl)-7-[4-(2-thienylsulfonyl)piperazino]heptane-1,4,7-trione Formula: C20H24N2O5S3 MolecularWeight: 468.60996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H24N2O5S3/c1-15-4-8-18(29-15)17(24)7-5-16(23)6-9-19(25)21-10-12-22(13-11-21)30(26,27)20-3-2-14-28-20/h2-4,8,14H,5-7,9-13H2,1H3