1-[3,7-bis(phenylsulfonylcarbamoylamino)naphthalen-1-yl]-3-(phenylsulfonyl)urea

Systemtic Name: 1-[3,7-bis(phenylsulfonylcarbamoylamino)naphthalen-1-yl]-3-(phenylsulfonyl)urea Openeye Name: 1-(benzenesulfonyl)-3-[3,7-bis(benzenesulfonylcarbamoylamino)-1-naphthyl]urea CAS Name: 1-(benzenesulfonyl)-3-[3,7-bis[[benzenesulfonamido(oxo)methyl]amino]-1-naphthalenyl]urea IUPAC Name: 1-(benzenesulfonyl)-3-[3,7-bis(benzenesulfonylcarbamoylamino)naphthalen-1-yl]urea Traditional Name: 1-besyl-3-[3,7-bis(besylcarbamoylamino)-1-naphthyl]urea Formula: C31H26N6O9S3 MolecularWeight: 722.76794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC3=C(C=C(C=C3C=C2)NC(=O)NS(=O)(=O)C4=CC=CC=C4)NC(=O)NS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC3=C(C=C(C=C3C=C2)NC(=O)NS(=O)(=O)C4=CC=CC=C4)NC(=O)NS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H26N6O9S3/c38-29(35-47(41,42)24-10-4-1-5-11-24)32-22-17-16-21-18-23(33-30(39)36-48(43,44)25-12-6-2-7-13-25)20-28(27(21)19-22)34-31(40)37-49(45,46)26-14-8-3-9-15-26/h1-20H,(H2,32,35,38)(H2,33,36,39)(H2,34,37,40)