1-[[2,7-bis[(4-pyridin-2-ylpiperazin-1-yl)sulfonyl]fluoren-9-ylidene]amino]urea

Systemtic Name: 1-[[2,7-bis[(4-pyridin-2-ylpiperazin-1-yl)sulfonyl]fluoren-9-ylidene]amino]urea Openeye Name: [[2,7-bis[[4-(2-pyridyl)piperazin-1-yl]sulfonyl]fluoren-9-ylidene]amino]urea CAS Name: [[2,7-bis[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]-9-fluorenylidene]amino]urea IUPAC Name: [[2,7-bis[(4-pyridin-2-ylpiperazin-1-yl)sulfonyl]fluoren-9-ylidene]amino]urea Traditional Name: [[2,7-bis[[4-(2-pyridyl)piperazino]sulfonyl]fluoren-9-ylidene]amino]urea Formula: C32H33N9O5S2 MolecularWeight: 687.79172

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)S(=O)(=O)C3=CC4=C(C=C3)C5=C(C4=NNC(=O)N)C=C(C=C5)S(=O)(=O)N6CCN(CC6)C7=CC=CC=N7

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)S(=O)(=O)C3=CC4=C(C=C3)C5=C(C4=NNC(=O)N)C=C(C=C5)S(=O)(=O)N6CCN(CC6)C7=CC=CC=N7

InChI

InChI=1S/C32H33N9O5S2/c33-32(42)37-36-31-27-21-23(47(43,44)40-17-13-38(14-18-40)29-5-1-3-11-34-29)7-9-25(27)26-10-8-24(22-28(26)31)48(45,46)41-19-15-39(16-20-41)30-6-2-4-12-35-30/h1-12,21-22H,13-20H2,(H3,33,37,42)