1,3-bis[7-(pyrimidin-2-ylsulfamoyl)naphthalen-2-yl]urea

Systemtic Name: 1,3-bis[7-(pyrimidin-2-ylsulfamoyl)naphthalen-2-yl]urea Openeye Name: 1,3-bis[7-(pyrimidin-2-ylsulfamoyl)-2-naphthyl]urea CAS Name: 1,3-bis[7-(2-pyrimidinylsulfamoyl)-2-naphthalenyl]urea IUPAC Name: 1,3-bis[7-(pyrimidin-2-ylsulfamoyl)naphthalen-2-yl]urea Traditional Name: 1,3-bis[7-(2-pyrimidylsulfamoyl)-2-naphthyl]urea Formula: C29H22N8O5S2 MolecularWeight: 626.66558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NS(=O)(=O)C2=CC3=C(C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C=CC(=C5)S(=O)(=O)NC6=NC=CC=N6)C=C2

Isomeric SMILES

C1=CN=C(N=C1)NS(=O)(=O)C2=CC3=C(C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C=CC(=C5)S(=O)(=O)NC6=NC=CC=N6)C=C2

InChI

InChI=1S/C29H22N8O5S2/c38-29(34-23-7-3-19-5-9-25(17-21(19)15-23)43(39,40)36-27-30-11-1-12-31-27)35-24-8-4-20-6-10-26(18-22(20)16-24)44(41,42)37-28-32-13-2-14-33-28/h1-18H,(H,30,31,36)(H,32,33,37)(H2,34,35,38)