1-ethyl-3-[3-[4-(6-morpholin-4-ylpyridin-3-yl)sulfonylpiperazin-1-yl]carbonyl-1-benzothiophen-2-yl]urea

Systemtic Name: 1-ethyl-3-[3-[4-(6-morpholin-4-ylpyridin-3-yl)sulfonylpiperazin-1-yl]carbonyl-1-benzothiophen-2-yl]urea Openeye Name: 1-ethyl-3-[3-[4-[(6-morpholino-3-pyridyl)sulfonyl]piperazine-1-carbonyl]benzothiophen-2-yl]urea CAS Name: 1-ethyl-3-[3-[[4-[[6-(4-morpholinyl)-3-pyridinyl]sulfonyl]-1-piperazinyl]-oxomethyl]-1-benzothiophen-2-yl]urea IUPAC Name: 1-ethyl-3-[3-[4-(6-morpholin-4-ylpyridin-3-yl)sulfonylpiperazine-1-carbonyl]-1-benzothiophen-2-yl]urea Traditional Name: 1-ethyl-3-[3-[4-[(6-morpholino-3-pyridyl)sulfonyl]piperazine-1-carbonyl]benzothiophen-2-yl]urea Formula: C25H30N6O5S2 MolecularWeight: 558.6729

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=C(C2=CC=CC=C2S1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CN=C(C=C4)N5CCOCC5

Isomeric SMILES

CCNC(=O)NC1=C(C2=CC=CC=C2S1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CN=C(C=C4)N5CCOCC5

InChI

InChI=1S/C25H30N6O5S2/c1-2-26-25(33)28-23-22(19-5-3-4-6-20(19)37-23)24(32)30-9-11-31(12-10-30)38(34,35)18-7-8-21(27-17-18)29-13-15-36-16-14-29/h3-8,17H,2,9-16H2,1H3,(H2,26,28,33)