1-(4-azidosulfonylphenyl)-3-[3-(3,5-dimethyl-4-oxidanyl-phenyl)propyl]urea

Systemtic Name: 1-(4-azidosulfonylphenyl)-3-[3-(3,5-dimethyl-4-oxidanyl-phenyl)propyl]urea Openeye Name: 1-(4-azidosulfonylphenyl)-3-[3-(4-hydroxy-3,5-dimethyl-phenyl)propyl]urea CAS Name: 1-(4-azidosulfonylphenyl)-3-[3-(4-hydroxy-3,5-dimethylphenyl)propyl]urea IUPAC Name: 1-(4-azidosulfonylphenyl)-3-[3-(4-hydroxy-3,5-dimethylphenyl)propyl]urea Traditional Name: 1-(4-azidosulfonylphenyl)-3-[3-(4-hydroxy-3,5-dimethyl-phenyl)propyl]urea Formula: C18H21N5O4S MolecularWeight: 403.45544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)CCCNC(=O)NC2=CC=C(C=C2)S(=O)(=O)N=[N+]=[N-]

Isomeric SMILES

CC1=CC(=CC(=C1O)C)CCCNC(=O)NC2=CC=C(C=C2)S(=O)(=O)N=[N+]=[N-]

InChI

InChI=1S/C18H21N5O4S/c1-12-10-14(11-13(2)17(12)24)4-3-9-20-18(25)21-15-5-7-16(8-6-15)28(26,27)23-22-19/h5-8,10-11,24H,3-4,9H2,1-2H3,(H2,20,21,25)