1-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]-4-thiophen-2-yl-butane-1,4-dione

Systemtic Name: 1-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]-4-thiophen-2-yl-butane-1,4-dione Openeye Name: 1-[4-(5-morpholinosulfonyl-2-pyridyl)piperazin-1-yl]-4-(2-thienyl)butane-1,4-dione CAS Name: 1-[4-[5-(4-morpholinylsulfonyl)-2-pyridinyl]-1-piperazinyl]-4-thiophen-2-ylbutane-1,4-dione IUPAC Name: 1-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]-4-thiophen-2-ylbutane-1,4-dione Traditional Name: 1-[4-(5-morpholinosulfonyl-2-pyridyl)piperazino]-4-(2-thienyl)butane-1,4-dione Formula: C21H26N4O5S2 MolecularWeight: 478.58494

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)CCC(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)CCC(=O)C4=CC=CS4

InChI

InChI=1S/C21H26N4O5S2/c26-18(19-2-1-15-31-19)4-6-21(27)24-9-7-23(8-10-24)20-5-3-17(16-22-20)32(28,29)25-11-13-30-14-12-25/h1-3,5,15-16H,4,6-14H2