1,3-bis[7-[(3-cyanophenyl)sulfamoyl]naphthalen-2-yl]urea

Systemtic Name: 1,3-bis[7-[(3-cyanophenyl)sulfamoyl]naphthalen-2-yl]urea Openeye Name: 1,3-bis[7-[(3-cyanophenyl)sulfamoyl]-2-naphthyl]urea CAS Name: 1,3-bis[7-[(3-cyanophenyl)sulfamoyl]-2-naphthalenyl]urea IUPAC Name: 1,3-bis[7-[(3-cyanophenyl)sulfamoyl]naphthalen-2-yl]urea Traditional Name: 1,3-bis[7-[(3-cyanophenyl)sulfamoyl]-2-naphthyl]urea Formula: C35H24N6O5S2 MolecularWeight: 672.73226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC3=C(C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C=CC(=C5)S(=O)(=O)NC6=CC=CC(=C6)C#N)C=C2)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC3=C(C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C=CC(=C5)S(=O)(=O)NC6=CC=CC(=C6)C#N)C=C2)C#N

InChI

InChI=1S/C35H24N6O5S2/c36-21-23-3-1-5-31(15-23)40-47(43,44)33-13-9-25-7-11-29(17-27(25)19-33)38-35(42)39-30-12-8-26-10-14-34(20-28(26)18-30)48(45,46)41-32-6-2-4-24(16-32)22-37/h1-20,40-41H,(H2,38,39,42)