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Amidapsone,Sulfacid,Sulfacide,Amidapsone (USAN),(p-Sulfanilylphenyl)ur

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摘 要:Amidapsone,Sulfacid,Sulfacide,Amidapsone (USAN),(p-Sulfanilylphenyl)urea,(4-Sulfanilylphenyl)urea,4-(N-Sulfanilyl)phenylurea,Amidapsone [USAN:INN],Amidapsonum [INN-Latin],Amidapsona [INN-Spanish], [4-(4-aminophenyl)sulfonylphenyl]urea,Canonical SMILE
[Synonyms]
Amidapsone
Sulfacid
Sulfacide
Amidapsone (USAN)
(p-Sulfanilylphenyl)urea
(4-Sulfanilylphenyl)urea
4-(N-Sulfanilyl)phenylurea
Amidapsone [USAN:INN]
Amidapsonum [INN-Latin]
Amidapsona [INN-Spanish]

[Structure]
Amidapsone,Sulfacid,Sulfacide,Amidapsone (USAN),(p-Sulfanilylphenyl)ur

[ Properties Computed from Structure]
Molecular Weight291.32562 [g/mol]
Molecular FormulaC13H13N3O3S
XLogP-0.4
H-Bond Donor3
H-Bond Acceptor4
Rotatable Bond Count3
Tautomer Count3
Exact Mass291.067762
MonoIsotopic Mass291.067762
Topological Polar Surface Area115
Heavy Atom Count20
Formal Charge0
Complexity430
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: [4-(4-aminophenyl)sulfonylphenyl]urea
Canonical SMILES: C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)NC(=O)N
InChI: InChI=1/C13H13N3O3S/c14-9-1-5-11(6-2-9)20(18,
19)12-7-3-10(4-8-12)16-13(15)17/h1-8H,14H2,(H3,15,16,17)/f/h16H,15H2

 
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