1-[4-(4-azidosulfonylphenoxy)phenyl]-3-[2-(3-dodecyl-4-oxidanyl-5-propyl-phenyl)ethyl]urea

Systemtic Name: 1-[4-(4-azidosulfonylphenoxy)phenyl]-3-[2-(3-dodecyl-4-oxidanyl-5-propyl-phenyl)ethyl]urea Openeye Name: 1-[4-(4-azidosulfonylphenoxy)phenyl]-3-[2-(3-dodecyl-4-hydroxy-5-propyl-phenyl)ethyl]urea CAS Name: 1-[4-(4-azidosulfonylphenoxy)phenyl]-3-[2-(3-dodecyl-4-hydroxy-5-propylphenyl)ethyl]urea IUPAC Name: 1-[4-(4-azidosulfonylphenoxy)phenyl]-3-[2-(3-dodecyl-4-hydroxy-5-propylphenyl)ethyl]urea Traditional Name: 1-[4-(4-azidosulfonylphenoxy)phenyl]-3-[2-(4-hydroxy-3-lauryl-5-propyl-phenyl)ethyl]urea Formula: C36H49N5O5S MolecularWeight: 663.86976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC(=CC(=C1O)CCC)CCNC(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)S(=O)(=O)N=[N+]=[N-]

Isomeric SMILES

CCCCCCCCCCCCC1=CC(=CC(=C1O)CCC)CCNC(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)S(=O)(=O)N=[N+]=[N-]

InChI

InChI=1S/C36H49N5O5S/c1-3-5-6-7-8-9-10-11-12-13-15-30-27-28(26-29(14-4-2)35(30)42)24-25-38-36(43)39-31-16-18-32(19-17-31)46-33-20-22-34(23-21-33)47(44,45)41-40-37/h16-23,26-27,42H,3-15,24-25H2,1-2H3,(H2,38,39,43)